3-[3-methyl-4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,3-diphenyl-butan-1-one

Systemtic Name: 3-[3-methyl-4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,3-diphenyl-butan-1-one Openeye Name: 3-[3-methyl-4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,3-diphenyl-butan-1-one CAS Name: 3-[3-methyl-4-[3-(4-methyl-1-piperazinyl)propoxy]phenyl]-1,3-diphenyl-1-butanone IUPAC Name: 3-[3-methyl-4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,3-diphenylbutan-1-one Traditional Name: 3-[3-methyl-4-[3-(4-methylpiperazino)propoxy]phenyl]-1,3-diphenyl-butan-1-one Formula: C31H38N2O2 MolecularWeight: 470.64562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3)OCCCN4CCN(CC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3)OCCCN4CCN(CC4)C

InChI

InChI=1S/C31H38N2O2/c1-25-23-28(15-16-30(25)35-22-10-17-33-20-18-32(3)19-21-33)31(2,27-13-8-5-9-14-27)24-29(34)26-11-6-4-7-12-26/h4-9,11-16,23H,10,17-22,24H2,1-3H3