4-[(4-chloranyl-2-nitro-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-chloranyl-2-nitro-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chloro-2-nitro-anilino)-2-(4-fluorophenyl)-4-oxo-butanoic acid CAS Name: 4-(4-chloro-2-nitroanilino)-2-(4-fluorophenyl)-4-oxobutanoic acid IUPAC Name: 4-(4-chloro-2-nitroanilino)-2-(4-fluorophenyl)-4-oxobutanoic acid Traditional Name: 4-(4-chloro-2-nitro-anilino)-2-(4-fluorophenyl)-4-keto-butyric acid Formula: C16H12ClFN2O5 MolecularWeight: 366.728283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)O)F

InChI

InChI=1S/C16H12ClFN2O5/c17-10-3-6-13(14(7-10)20(24)25)19-15(21)8-12(16(22)23)9-1-4-11(18)5-2-9/h1-7,12H,8H2,(H,19,21)(H,22,23)