ethyl 6-nitro-2-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-nitro-2-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-nitro-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 6-nitro-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-nitro-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 2-keto-6-nitro-7-(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=CC2=CC(=C(C=C2NC1=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC2=CC(=C(C=C2NC1=O)C(F)(F)F)[N+](=O)[O-]

InChI

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