[2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate

Systemtic Name: [2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate Openeye Name: [2-(2-bromo-4-nitro-anilino)-2-oxo-ethyl] 2-(3-fluoro-4-methoxy-phenyl)acetate CAS Name: 2-(3-fluoro-4-methoxyphenyl)acetic acid [2-(2-bromo-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-nitroanilino)-2-oxoethyl] 2-(3-fluoro-4-methoxyphenyl)acetate Traditional Name: 2-(3-fluoro-4-methoxy-phenyl)acetic acid [2-(2-bromo-4-nitro-anilino)-2-keto-ethyl] ester Formula: C17H14BrFN2O6 MolecularWeight: 441.205263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)F

InChI

InChI=1S/C17H14BrFN2O6/c1-26-15-5-2-10(6-13(15)19)7-17(23)27-9-16(22)20-14-4-3-11(21(24)25)8-12(14)18/h2-6,8H,7,9H2,1H3,(H,20,22)