dimethyl-(4-methyl-3-oxidanyl-phenyl)-prop-2-enyl-azanium; N-methylcarbamate; hydrochloride

Systemtic Name: dimethyl-(4-methyl-3-oxidanyl-phenyl)-prop-2-enyl-azanium; N-methylcarbamate; hydrochloride Openeye Name: allyl-(3-hydroxy-4-methyl-phenyl)-dimethyl-ammonium; N-methylcarbamate; hydrochloride CAS Name: (3-hydroxy-4-methylphenyl)-dimethyl-prop-2-enylammonium; N-methylcarbamate; hydrochloride IUPAC Name: (3-hydroxy-4-methylphenyl)-dimethyl-prop-2-enylazanium; N-methylcarbamate; hydrochloride Traditional Name: allyl-(3-hydroxy-4-methyl-phenyl)-dimethyl-ammonium; N-methylcarbamate; hydrochloride Formula: C14H23ClN2O3 MolecularWeight: 302.79702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](C)(C)CC=C)O.CNC(=O)[O-].Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](C)(C)CC=C)O.CNC(=O)[O-].Cl

InChI

InChI=1S/C12H17NO.C2H5NO2.ClH/c1-5-8-13(3,4)11-7-6-10(2)12(14)9-11;1-3-2(4)5;/h5-7,9H,1,8H2,2-4H3;3H,1H3,(H,4,5);1H