4-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 4-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisocarbostyril Formula: C34H32FN3O4 MolecularWeight: 565.633983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC)C(=O)N5CCN(CC5)C6=CC=CC=C6F

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC)C(=O)N5CCN(CC5)C6=CC=CC=C6F

InChI

InChI=1S/C34H32FN3O4/c1-41-25-15-11-23(12-16-25)32-31(34(40)37-21-19-36(20-22-37)30-10-6-5-9-29(30)35)27-7-3-4-8-28(27)33(39)38(32)24-13-17-26(42-2)18-14-24/h3-18,31-32H,19-22H2,1-2H3