ethyl 1-cyclopropyl-6,7,8-tris(fluoranyl)-2-(2-nitrophenyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-6,7,8-tris(fluoranyl)-2-(2-nitrophenyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-6,7,8-trifluoro-2-(2-nitrophenyl)-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-6,7,8-trifluoro-2-(2-nitrophenyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-6,7,8-trifluoro-2-(2-nitrophenyl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-cyclopropyl-6,7,8-trifluoro-4-keto-2-(2-nitrophenyl)quinoline-3-carboxylic acid ethyl ester Formula: C21H15F3N2O5 MolecularWeight: 432.34941

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C(=C(C=C2C1=O)F)F)F)C3CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C(=C(C=C2C1=O)F)F)F)C3CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H15F3N2O5/c1-2-31-21(28)15-18(11-5-3-4-6-14(11)26(29)30)25(10-7-8-10)19-12(20(15)27)9-13(22)16(23)17(19)24/h3-6,9-10H,2,7-8H2,1H3