2-cyclohexyl-5-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-cyclohexyl-5-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-cyclohexyl-5-[4-(3,3-diphenylpropyl)piperazin-1-yl]isoindolin-1-one CAS Name: 2-cyclohexyl-5-[4-(3,3-diphenylpropyl)-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-cyclohexyl-5-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-5-[4-(3,3-diphenylpropyl)piperazino]isoindolin-1-one Formula: C33H39N3O MolecularWeight: 493.68226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H39N3O/c37-33-32-17-16-30(24-28(32)25-36(33)29-14-8-3-9-15-29)35-22-20-34(21-23-35)19-18-31(26-10-4-1-5-11-26)27-12-6-2-7-13-27/h1-2,4-7,10-13,16-17,24,29,31H,3,8-9,14-15,18-23,25H2