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

Systemtic Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoranyl-2-phenyl-3,4-dihydroisoquinolin-1-one Openeye Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoro-2-phenyl-3,4-dihydroisoquinolin-1-one CAS Name: 7-[4-(3,3-diphenylpropyl)-1-piperazinyl]-4-fluoro-2-phenyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 7-[4-(3,3-diphenylpropyl)piperazin-1-yl]-4-fluoro-2-phenyl-3,4-dihydroisoquinolin-1-one Traditional Name: 7-[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)C4=CC5=C(C=C4)C(CN(C5=O)C6=CC=CC=C6)F

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)C(CN(C5=O)C6=CC=CC=C6)F

InChI

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