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

Systemtic Name: 2-[1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]-3-(1-methyl-2-phenyl-indol-3-yl)-3H-isoindol-1-one Openeye Name: 2-[1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-methyl-butyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one CAS Name: 2-[1-[4-(3-chlorophenyl)-1-piperazinyl]-3-methyl-1-oxopentan-2-yl]-3-(1-methyl-2-phenyl-3-indolyl)-3H-isoindol-1-one IUPAC Name: 2-[1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxopentan-2-yl]-3-(1-methyl-2-phenylindol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-methyl-butyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one Formula: C39H39ClN4O2 MolecularWeight: 631.20556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

InChI

InChI=1S/C39H39ClN4O2/c1-4-26(2)35(39(46)43-23-21-42(22-24-43)29-16-12-15-28(40)25-29)44-37(30-17-8-9-18-31(30)38(44)45)34-32-19-10-11-20-33(32)41(3)36(34)27-13-6-5-7-14-27/h5-20,25-26,35,37H,4,21-24H2,1-3H3