(2R)-4-[(2-bromanyl-4-nitro-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(2-bromanyl-4-nitro-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(2-bromo-4-nitro-anilino)-2-(4-fluorophenyl)-4-oxo-butanoate CAS Name: (2R)-4-(2-bromo-4-nitroanilino)-2-(4-fluorophenyl)-4-oxobutanoate IUPAC Name: (2R)-4-(2-bromo-4-nitroanilino)-2-(4-fluorophenyl)-4-oxobutanoate Traditional Name: (2R)-4-(2-bromo-4-nitro-anilino)-2-(4-fluorophenyl)-4-keto-butyrate Formula: C16H11BrFN2O5- MolecularWeight: 410.171343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC=C1[C@@H](CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)[O-])F

InChI

InChI=1S/C16H12BrFN2O5/c17-13-7-11(20(24)25)5-6-14(13)19-15(21)8-12(16(22)23)9-1-3-10(18)4-2-9/h1-7,12H,8H2,(H,19,21)(H,22,23)/p-1/t12-/m1/s1