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

Systemtic Name: 2-[1-[4-(diphenylmethyl)piperazin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(1-methyl-2-phenyl-indol-3-yl)-3H-isoindol-1-one Openeye Name: 2-[1-(4-benzhydrylpiperazine-1-carbonyl)-3-methyl-butyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one CAS Name: 2-[1-[4-(diphenylmethyl)-1-piperazinyl]-4-methyl-1-oxopentan-2-yl]-3-(1-methyl-2-phenyl-3-indolyl)-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzhydrylpiperazin-1-yl)-4-methyl-1-oxopentan-2-yl]-3-(1-methyl-2-phenylindol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[1-(4-benzhydrylpiperazine-1-carbonyl)-3-methyl-butyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one Formula: C46H46N4O2 MolecularWeight: 686.88304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)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)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/C46H46N4O2/c1-32(2)31-40(46(52)49-29-27-48(28-30-49)42(33-17-7-4-8-18-33)34-19-9-5-10-20-34)50-44(36-23-13-14-24-37(36)45(50)51)41-38-25-15-16-26-39(38)47(3)43(41)35-21-11-6-12-22-35/h4-26,32,40,42,44H,27-31H2,1-3H3