2-methoxyethyl 4-[(2-fluoranyl-5-nitro-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(2-fluoranyl-5-nitro-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-(2-fluoro-5-nitro-anilino)-4-oxo-butanoate CAS Name: 4-(2-fluoro-5-nitroanilino)-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(2-fluoro-5-nitroanilino)-4-oxobutanoate Traditional Name: 4-(2-fluoro-5-nitro-anilino)-4-keto-butyric acid 2-methoxyethyl ester Formula: C13H15FN2O6 MolecularWeight: 314.266403

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F

Isomeric SMILES

COCCOC(=O)CCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F

InChI

InChI=1S/C13H15FN2O6/c1-21-6-7-22-13(18)5-4-12(17)15-11-8-9(16(19)20)2-3-10(11)14/h2-3,8H,4-7H2,1H3,(H,15,17)