Sal de merck

PubChem Notes:

Cocaine An alkaloid ester extracted from the leaves of plants including coca. It is a local anesthetic and vasoconstrictor and is clinically used for that purpose, particularly in the eye, ear, nose, and throat. It also has powerful central nervous system effects similar to the amphetamines and is a drug of abuse. Cocaine, like amphetamines, acts by multiple mechanisms on brain catecholaminergic neurons; the mechanism of its reinforcing effects is thought to involve inhibition of dopamine uptake.

Molecular Formula: C17H21NO4


InChI: InChI=1/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3

InChIKey: InChIKey=ZPUCINDJVBIVPJ-UHFFFAOYAP
SMILES: CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)OC

Names:
    Cocaine chloride
    COCAINE HYDROCHLORIDE
    Cocaine muriate
    COCAINE, HYDROCHLORIDE
    l-Cocaine hydrochloride
    methyl 3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
    NSC25263
    Sal de merck
    (-)-Cocaine hydrochloride
    1.alpha.H,5.alpha.H-Tropane-2.beta.-carboxylic acid, 3.beta.-hydroxy-, methyl ester, benzoate (ester), hydrochloride
    1.alpha.-H,5.alpha.-H-Tropane-2.beta.-carboxylic acid, 3.beta.-hydroxy-, methyl ester, benzoate(ester), hydrochloride

Registries:
    PubChem CID 2826
    PubChem ID 542495