4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]-3-methyl-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]-3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 4-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]-3-methyl-1-(4-methylpiperazino)butan-1-one Formula: C27H34BrN3O2 MolecularWeight: 512.48176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CC(C)CC(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CC(C)CC(=O)N4CCN(CC4)C

InChI

InChI=1S/C27H34BrN3O2/c1-19(16-27(32)30-13-11-29(3)12-14-30)15-24-20(2)31(18-21-5-7-22(28)8-6-21)26-10-9-23(33-4)17-25(24)26/h5-10,17,19H,11-16,18H2,1-4H3