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

Systemtic Name: ethyl 2-(4-chloranyl-2-nitro-phenyl)-1-cyclopropyl-6,7,8-tris(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 2-(4-chloro-2-nitro-phenyl)-1-cyclopropyl-6,7,8-trifluoro-4-oxo-quinoline-3-carboxylate CAS Name: 2-(4-chloro-2-nitrophenyl)-1-cyclopropyl-6,7,8-trifluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chloro-2-nitrophenyl)-1-cyclopropyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylate Traditional Name: 2-(4-chloro-2-nitro-phenyl)-1-cyclopropyl-6,7,8-trifluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C21H14ClF3N2O5 MolecularWeight: 466.79447

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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=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClF3N2O5/c1-2-32-21(29)15-18(11-6-3-9(22)7-14(11)27(30)31)26(10-4-5-10)19-12(20(15)28)8-13(23)16(24)17(19)25/h3,6-8,10H,2,4-5H2,1H3