ethyl 6-bromanyl-2-(dimethylaminomethyl)-5-oxidanyl-1-phenyl-indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 6-bromanyl-2-(dimethylaminomethyl)-5-oxidanyl-1-phenyl-indole-3-carboxylate hydrochloride Openeye Name: ethyl 6-bromo-2-(dimethylaminomethyl)-5-hydroxy-1-phenyl-indole-3-carboxylate hydrochloride CAS Name: 6-bromo-2-(dimethylaminomethyl)-5-hydroxy-1-phenyl-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 6-bromo-2-(dimethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate hydrochloride Traditional Name: 6-bromo-2-(dimethylaminomethyl)-5-hydroxy-1-phenyl-indole-3-carboxylic acid ethyl ester hydrochloride Formula: C20H22BrClN2O3 MolecularWeight: 453.75728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O3.ClH/c1-4-26-20(25)19-14-10-18(24)15(21)11-16(14)23(17(19)12-22(2)3)13-8-6-5-7-9-13;/h5-11,24H,4,12H2,1-3H3;1H