3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoranyl-2-phenyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoranyl-2-phenyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoro-2-phenyl-3,4-dihydroisoquinolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-4-fluoro-2-phenyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoro-2-phenyl-3,4-dihydroisoquinolin-1-one Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-4-fluoro-2-phenyl-3,4-dihydroisocarbostyril Formula: C34H34FN3O MolecularWeight: 519.651663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4C(C5=CC=CC=C5C(=O)N4C6=CC=CC=C6)F

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4C(C5=CC=CC=C5C(=O)N4C6=CC=CC=C6)F

InChI

InChI=1S/C34H34FN3O/c35-32-30-18-10-11-19-31(30)34(39)38(28-16-8-3-9-17-28)33(32)37-24-22-36(23-25-37)21-20-29(26-12-4-1-5-13-26)27-14-6-2-7-15-27/h1-19,29,32-33H,20-25H2