ethyl 6-(dimethylaminomethyl)-2-methyl-5-oxidanyl-1-(phenylmethyl)indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 6-(dimethylaminomethyl)-2-methyl-5-oxidanyl-1-(phenylmethyl)indole-3-carboxylate hydrochloride Openeye Name: ethyl 1-benzyl-6-(dimethylaminomethyl)-5-hydroxy-2-methyl-indole-3-carboxylate hydrochloride CAS Name: 6-(dimethylaminomethyl)-5-hydroxy-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-benzyl-6-(dimethylaminomethyl)-5-hydroxy-2-methylindole-3-carboxylate hydrochloride Traditional Name: 1-benzyl-6-(dimethylaminomethyl)-5-hydroxy-2-methyl-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=CC(=C(C=C21)O)CN(C)C)CC3=CC=CC=C3)C.Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)CN(C)C)CC3=CC=CC=C3)C.Cl

InChI

InChI=1S/C22H26N2O3.ClH/c1-5-27-22(26)21-15(2)24(13-16-9-7-6-8-10-16)19-11-17(14-23(3)4)20(25)12-18(19)21;/h6-12,25H,5,13-14H2,1-4H3;1H