ethyl 4-(dimethylaminomethyl)-2-methyl-1-(2-methylphenyl)-5-oxidanyl-indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 4-(dimethylaminomethyl)-2-methyl-1-(2-methylphenyl)-5-oxidanyl-indole-3-carboxylate hydrochloride Openeye Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-methyl-1-(o-tolyl)indole-3-carboxylate hydrochloride CAS Name: 4-(dimethylaminomethyl)-5-hydroxy-2-methyl-1-(2-methylphenyl)-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-methyl-1-(2-methylphenyl)indole-3-carboxylate hydrochloride Traditional Name: 4-(dimethylaminomethyl)-5-hydroxy-2-methyl-1-(o-tolyl)indole-3-carboxylic acid ethyl ester hydrochloride Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN(C)C)C3=CC=CC=C3C)C.Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN(C)C)C3=CC=CC=C3C)C.Cl

InChI

InChI=1S/C22H26N2O3.ClH/c1-6-27-22(26)20-15(3)24(17-10-8-7-9-14(17)2)18-11-12-19(25)16(21(18)20)13-23(4)5;/h7-12,25H,6,13H2,1-5H3;1H