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

Systemtic Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-ethoxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 7-[4-(3,3-diphenylpropyl)piperazino]-2-(4-ethoxybenzyl)-3,4-dihydroisocarbostyril Formula: C37H41N3O2 MolecularWeight: 559.74034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C37H41N3O2/c1-2-42-34-17-13-29(14-18-34)28-40-22-19-32-15-16-33(27-36(32)37(40)41)39-25-23-38(24-26-39)21-20-35(30-9-5-3-6-10-30)31-11-7-4-8-12-31/h3-18,27,35H,2,19-26,28H2,1H3