[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-fluorophenyl)methoxy]benzoate

Systemtic Name: [2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-fluorophenyl)methoxy]benzoate Openeye Name: [2-(4-methoxy-2-nitro-anilino)-2-oxo-ethyl] 3-[(4-fluorophenyl)methoxy]benzoate CAS Name: 3-[(4-fluorophenyl)methoxy]benzoic acid [2-(4-methoxy-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxy-2-nitroanilino)-2-oxoethyl] 3-[(4-fluorophenyl)methoxy]benzoate Traditional Name: 3-(4-fluorobenzyl)oxybenzoic acid [2-keto-2-(4-methoxy-2-nitro-anilino)ethyl] ester Formula: C23H19FN2O7 MolecularWeight: 454.404563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)OCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)OCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C23H19FN2O7/c1-31-18-9-10-20(21(12-18)26(29)30)25-22(27)14-33-23(28)16-3-2-4-19(11-16)32-13-15-5-7-17(24)8-6-15/h2-12H,13-14H2,1H3,(H,25,27)