3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(E)-3-phenylprop-2-enyl]-3H-isoindol-1-one

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(E)-3-phenylprop-2-enyl]-3H-isoindol-1-one Openeye Name: 2-[(E)-cinnamyl]-3-[4-(3,3-diphenylpropyl)piperazin-1-yl]isoindolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-[(E)-3-phenylprop-2-enyl]-3H-isoindol-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(E)-3-phenylprop-2-enyl]-3H-isoindol-1-one Traditional Name: 2-[(E)-cinnamyl]-3-[4-(3,3-diphenylpropyl)piperazino]isoindolin-1-one Formula: C36H37N3O MolecularWeight: 527.69848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4C5=CC=CC=C5C(=O)N4CC=CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4C5=CC=CC=C5C(=O)N4C/C=C/C6=CC=CC=C6

InChI

InChI=1S/C36H37N3O/c40-36-34-21-11-10-20-33(34)35(39(36)23-12-15-29-13-4-1-5-14-29)38-27-25-37(26-28-38)24-22-32(30-16-6-2-7-17-30)31-18-8-3-9-19-31/h1-21,32,35H,22-28H2/b15-12+