ethyl 2-(5-chloranyl-2-fluoranyl-phenyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-(5-chloranyl-2-fluoranyl-phenyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-(5-chloro-2-fluoro-phenyl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 2-(5-chloro-2-fluorophenyl)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(5-chloro-2-fluorophenyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 2-(5-chloro-2-fluoro-phenyl)-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H13ClFNO3 MolecularWeight: 345.752123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC=CC=C2C1=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2C1=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C18H13ClFNO3/c1-2-24-18(23)15-16(12-9-10(19)7-8-13(12)20)21-14-6-4-3-5-11(14)17(15)22/h3-9H,2H2,1H3,(H,21,22)