propyl 2-(4-fluorophenyl)-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: propyl 2-(4-fluorophenyl)-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: propyl 2-(4-fluorophenyl)-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-1-oxo-4-isoquinolinecarboxylic acid propyl ester IUPAC Name: propyl 2-(4-fluorophenyl)-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)-1-keto-isoquinoline-4-carboxylic acid propyl ester Formula: C19H16FNO3 MolecularWeight: 325.333643

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CCCOC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FNO3/c1-2-11-24-19(23)17-12-21(14-9-7-13(20)8-10-14)18(22)16-6-4-3-5-15(16)17/h3-10,12H,2,11H2,1H3