ethyl 7-chloranyl-6-fluoranyl-4-oxidanylidene-5-(1-oxidanylidenebutan-2-ylamino)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 7-chloranyl-6-fluoranyl-4-oxidanylidene-5-(1-oxidanylidenebutan-2-ylamino)-1H-quinoline-3-carboxylate Openeye Name: ethyl 7-chloro-6-fluoro-5-(1-formylpropylamino)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 7-chloro-6-fluoro-4-oxo-5-(1-oxobutan-2-ylamino)-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-6-fluoro-4-oxo-5-(1-oxobutan-2-ylamino)-1H-quinoline-3-carboxylate Traditional Name: 7-chloro-6-fluoro-5-(1-formylpropylamino)-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C16H16ClFN2O4 MolecularWeight: 354.760643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=O)NC1=C2C(=CC(=C1F)Cl)NC=C(C2=O)C(=O)OCC

Isomeric SMILES

CCC(C=O)NC1=C2C(=CC(=C1F)Cl)NC=C(C2=O)C(=O)OCC

InChI

InChI=1S/C16H16ClFN2O4/c1-3-8(7-21)20-14-12-11(5-10(17)13(14)18)19-6-9(15(12)22)16(23)24-4-2/h5-8,20H,3-4H2,1-2H3,(H,19,22)