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

Systemtic Name: 6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(4-methoxyphenyl)-3H-isoindol-1-one Openeye Name: 6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(4-methoxyphenyl)isoindolin-1-one CAS Name: 6-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one IUPAC Name: 6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(4-methoxyphenyl)-3H-isoindol-1-one Traditional Name: 6-[4-(3,3-diphenylpropyl)piperazino]-2-(4-methoxyphenyl)isoindolin-1-one Formula: C34H35N3O2 MolecularWeight: 517.6606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H35N3O2/c1-39-31-16-14-29(15-17-31)37-25-28-12-13-30(24-33(28)34(37)38)36-22-20-35(21-23-36)19-18-32(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-17,24,32H,18-23,25H2,1H3