3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[4-(2-pyridyl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-1-one CAS Name: 3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-(4-pyridin-2-ylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[4-(2-pyridyl)piperazine-1-carbonyl]-3,4-dihydroisocarbostyril Formula: C28H29FN4O3 MolecularWeight: 488.553263

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)F

Isomeric SMILES

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H29FN4O3/c1-36-19-18-33-26(20-9-11-21(29)12-10-20)25(22-6-2-3-7-23(22)27(33)34)28(35)32-16-14-31(15-17-32)24-8-4-5-13-30-24/h2-13,25-26H,14-19H2,1H3