2-[1-[4-(diphenylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one

Systemtic Name: 2-[1-[4-(diphenylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Openeye Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one CAS Name: 2-[1-[4-(diphenylmethyl)-1-piperazinyl]-1-oxopropan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzhydrylpiperazin-1-yl)-1-oxopropan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[2-(4-benzhydrylpiperazino)-2-keto-1-methyl-ethyl]-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one Formula: C42H38N4O2 MolecularWeight: 630.77672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)N4C(C5=CC=CC=C5C4=O)C6=C(NC7=CC=CC=C76)C8=CC=CC=C8

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)N4C(C5=CC=CC=C5C4=O)C6=C(NC7=CC=CC=C76)C8=CC=CC=C8

InChI

InChI=1S/C42H38N4O2/c1-29(41(47)45-27-25-44(26-28-45)39(31-17-7-3-8-18-31)32-19-9-4-10-20-32)46-40(33-21-11-12-22-34(33)42(46)48)37-35-23-13-14-24-36(35)43-38(37)30-15-5-2-6-16-30/h2-24,29,39-40,43H,25-28H2,1H3