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

Systemtic Name: 2-cyclopropyl-4-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-cyclopropyl-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-cyclopropyl-4-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-cyclopropyl-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-cyclopropyl-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(3-methoxyphenyl)-3,4-dihydroisocarbostyril Formula: C30H30FN3O3 MolecularWeight: 499.575903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)N5CCN(CC5)C6=CC=CC=C6F

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)N5CCN(CC5)C6=CC=CC=C6F

InChI

InChI=1S/C30H30FN3O3/c1-37-22-8-6-7-20(19-22)28-27(23-9-2-3-10-24(23)29(35)34(28)21-13-14-21)30(36)33-17-15-32(16-18-33)26-12-5-4-11-25(26)31/h2-12,19,21,27-28H,13-18H2,1H3