O1-ethyl O4-[(2R)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(2R)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-2-(4-fluoro-3-nitro-anilino)-1-methyl-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(2R)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-ethyl 4-O-[(2R)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-(4-fluoro-3-nitro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C15H15FN2O7 MolecularWeight: 354.287203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C)C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C15H15FN2O7/c1-3-24-13(19)6-7-14(20)25-9(2)15(21)17-10-4-5-11(16)12(8-10)18(22)23/h4-9H,3H2,1-2H3,(H,17,21)/b7-6+/t9-/m1/s1