2-(cyclohexylmethyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-(cyclohexylmethyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-(cyclohexylmethyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]isoindolin-1-one CAS Name: 2-(cyclohexylmethyl)-6-[4-(3,3-diphenylpropyl)-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-(cyclohexylmethyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-(cyclohexylmethyl)-6-[4-(3,3-diphenylpropyl)piperazino]isoindolin-1-one Formula: C34H41N3O MolecularWeight: 507.70884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)CN2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H41N3O/c38-34-33-24-31(17-16-30(33)26-37(34)25-27-10-4-1-5-11-27)36-22-20-35(21-23-36)19-18-32(28-12-6-2-7-13-28)29-14-8-3-9-15-29/h2-3,6-9,12-17,24,27,32H,1,4-5,10-11,18-23,25-26H2