ethyl 1-(4-fluorophenyl)-7-(3-methyl-1,2-oxazol-5-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-7-(3-methyl-1,2-oxazol-5-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-7-(3-methylisoxazol-5-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 1-(4-fluorophenyl)-7-(3-methyl-5-isoxazolyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-7-(3-methyl-1,2-oxazol-5-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4-keto-7-(3-methylisoxazol-5-yl)quinoline-3-carboxylic acid ethyl ester Formula: C22H17FN2O4 MolecularWeight: 392.379783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2)C3=CC(=NO3)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2)C3=CC(=NO3)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN2O4/c1-3-28-22(27)18-12-25(16-7-5-15(23)6-8-16)19-11-14(4-9-17(19)21(18)26)20-10-13(2)24-29-20/h4-12H,3H2,1-2H3