ethyl 6-bromanyl-4-(dimethylaminomethyl)-2-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-5-oxidanyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-(dimethylaminomethyl)-2-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-5-oxidanyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-2-[[4-(o-tolyl)piperazin-1-yl]methyl]-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-2-[[4-(2-methylphenyl)-1-piperazinyl]methyl]-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-2-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-2-[[4-(o-tolyl)piperazino]methyl]-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C32H37BrN4O3 MolecularWeight: 605.56518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=CC=C3)CN4CCN(CC4)C5=CC=CC=C5C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=CC=C3)CN4CCN(CC4)C5=CC=CC=C5C

InChI

InChI=1S/C32H37BrN4O3/c1-5-40-32(39)30-28(21-35-15-17-36(18-16-35)26-14-10-9-11-22(26)2)37(23-12-7-6-8-13-23)27-19-25(33)31(38)24(29(27)30)20-34(3)4/h6-14,19,38H,5,15-18,20-21H2,1-4H3