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    Arlitene

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    Xls

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    2D Structure
    Also known as: Vasoklin, Opilon, M-101, Moxisylyte hcl, Wv 365, Wk2kzm9v6x
    Molecular Formula
    C16H26ClNO3
    Molecular Weight
    315.83  g/mol
    InChI Key
    IPWGSXZCDPTDEH-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(4-acetyloxy-5-methyl-2-propan-2-ylphenoxy)ethyl-dimethylazanium;chloride
    2.1.2 InChI
    InChI=1S/C16H25NO3.ClH/c1-11(2)14-10-15(20-13(4)18)12(3)9-16(14)19-8-7-17(5)6;/h9-11H,7-8H2,1-6H3;1H
    2.1.3 InChI Key
    IPWGSXZCDPTDEH-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=CC(=C(C=C1OC(=O)C)C(C)C)OCC[NH+](C)C.[Cl-]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Vasoklin

    2. Opilon

    3. M-101

    4. Moxisylyte Hcl

    5. Wv 365

    6. Wk2kzm9v6x

    7. Enfrental

    8. Limatene

    9. 2-(4-acetyloxy-5-methyl-2-propan-2-ylphenoxy)ethyl-dimethylazanium;chloride

    10. [4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenyl] Acetate;hydron;chloride

    11. 5-(2-(n,n-dimethylamino)ethoxy)carvacrol Acetate Hydrochloride

    12. Einecs 213-519-4

    13. Nsc 170448

    14. Unii-wk2kzm9v6x

    15. Dtxsid9046946

    16. Chlorhydrate De Acetoxy-thymoxy-ethyl-dimethylamine [french]

    17. (2-(4-acetoxy-2-isopropyl-5-methylphenoxy)ethyl)dimethylamine Hydrochloride

    18. Carvacrol, 5-(2-(dimethylamino)ethoxy)-, Acetate (ester), Hydrochloride

    19. Carvacrol, 5-(2-(n,n-dimethylamino)ethoxy)-, Acetate, Hydrochloride

    20. Phenol, 4-(2-(dimethylamino)ethoxy)-2-methyl-5-(1-methylethyl)-, Acetate (ester), Hydrochloride

    21. Chlorhydrate De Acetoxy-thymoxy-ethyl-dimethylamine

    2.3 Create Date
    2005-06-24
    3 Chemical and Physical Properties
    Molecular Weight 315.83 g/mol
    Molecular Formula C16H26ClNO3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count7
    Exact Mass315.1601214 g/mol
    Monoisotopic Mass315.1601214 g/mol
    Topological Polar Surface Area40 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity304
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2