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

Systemtic Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4,4-dimethyl-2,3-dihydroisoquinolin-1-one Openeye Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4,4-dimethyl-2,3-dihydroisoquinolin-1-one CAS Name: 7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-4,4-dimethyl-2,3-dihydroisoquinolin-1-one IUPAC Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4,4-dimethyl-2,3-dihydroisoquinolin-1-one Traditional Name: 7-[4-(3,3-diphenylpropyl)piperazino]-4,4-dimethyl-2,3-dihydroisoquinolin-1-one Formula: C30H35N3O MolecularWeight: 453.6184

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC(=O)C2=C1C=CC(=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1(CNC(=O)C2=C1C=CC(=C2)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C30H35N3O/c1-30(2)22-31-29(34)27-21-25(13-14-28(27)30)33-19-17-32(18-20-33)16-15-26(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-14,21,26H,15-20,22H2,1-2H3,(H,31,34)