2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-4-pyrrolidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-4-pyrrolidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-4-[oxo(1-pyrrolidinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-(4-fluorobenzyl)-3-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C28H27FN2O3 MolecularWeight: 458.523983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F)C(=O)N5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F)C(=O)N5CCCC5

InChI

InChI=1S/C28H27FN2O3/c1-34-22-14-10-20(11-15-22)26-25(28(33)30-16-4-5-17-30)23-6-2-3-7-24(23)27(32)31(26)18-19-8-12-21(29)13-9-19/h2-3,6-15,25-26H,4-5,16-18H2,1H3