7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-prop-2-enyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-prop-2-enyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-allyl-7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3,4-dihydroisoquinolin-1-one CAS Name: 7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-prop-2-enyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-prop-2-enyl-3,4-dihydroisoquinolin-1-one Traditional Name: 2-allyl-7-[4-(3,3-diphenylpropyl)piperazino]-3,4-dihydroisocarbostyril Formula: C31H35N3O MolecularWeight: 465.6291

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCC2=C(C1=O)C=C(C=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CCN1CCC2=C(C1=O)C=C(C=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O/c1-2-17-34-19-15-27-13-14-28(24-30(27)31(34)35)33-22-20-32(21-23-33)18-16-29(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h2-14,24,29H,1,15-23H2