ethyl 6-nitro-4-oxidanylidene-2-(trifluoromethyl)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-nitro-4-oxidanylidene-2-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-nitro-4-oxo-2-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 6-nitro-4-oxo-2-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-nitro-4-oxo-2-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 4-keto-6-nitro-2-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C13H9F3N2O5 MolecularWeight: 330.21617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H9F3N2O5/c1-2-23-12(20)9-10(19)7-5-6(18(21)22)3-4-8(7)17-11(9)13(14,15)16/h3-5H,2H2,1H3,(H,17,19)