2-cyclohexyl-6-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-cyclohexyl-6-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-cyclohexyl-6-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]isoindolin-1-one CAS Name: 2-cyclohexyl-6-[4-[(4-phenylphenyl)methyl]-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-cyclohexyl-6-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-6-[4-(4-phenylbenzyl)piperazino]isoindolin-1-one Formula: C31H35N3O MolecularWeight: 465.6291

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CC5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CC5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H35N3O/c35-31-30-21-29(16-15-27(30)23-34(31)28-9-5-2-6-10-28)33-19-17-32(18-20-33)22-24-11-13-26(14-12-24)25-7-3-1-4-8-25/h1,3-4,7-8,11-16,21,28H,2,5-6,9-10,17-20,22-23H2