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

Systemtic Name: 2-[1-[4-(diphenylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3-(1-methyl-2-phenyl-indol-3-yl)-3H-isoindol-1-one Openeye Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one CAS Name: 2-[1-[4-(diphenylmethyl)-1-piperazinyl]-1-oxopropan-2-yl]-3-(1-methyl-2-phenyl-3-indolyl)-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzhydrylpiperazin-1-yl)-1-oxopropan-2-yl]-3-(1-methyl-2-phenylindol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[2-(4-benzhydrylpiperazino)-2-keto-1-methyl-ethyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one Formula: C43H40N4O2 MolecularWeight: 644.8033

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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(N(C7=CC=CC=C76)C)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(N(C7=CC=CC=C76)C)C8=CC=CC=C8

InChI

InChI=1S/C43H40N4O2/c1-30(42(48)46-28-26-45(27-29-46)39(31-16-6-3-7-17-31)32-18-8-4-9-19-32)47-41(34-22-12-13-23-35(34)43(47)49)38-36-24-14-15-25-37(36)44(2)40(38)33-20-10-5-11-21-33/h3-25,30,39,41H,26-29H2,1-2H3