[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-fluoranylphenoxy)-2-methyl-propanoate

Systemtic Name: [2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-fluoranylphenoxy)-2-methyl-propanoate Openeye Name: [2-(2-fluoro-5-nitro-anilino)-2-oxo-ethyl] 2-(4-fluorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-fluorophenoxy)-2-methylpropanoic acid [2-(2-fluoro-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-fluoro-5-nitroanilino)-2-oxoethyl] 2-(4-fluorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-fluorophenoxy)-2-methyl-propionic acid [2-(2-fluoro-5-nitro-anilino)-2-keto-ethyl] ester Formula: C18H16F2N2O6 MolecularWeight: 394.326246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F)OC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C(=O)OCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F)OC2=CC=C(C=C2)F

InChI

InChI=1S/C18H16F2N2O6/c1-18(2,28-13-6-3-11(19)4-7-13)17(24)27-10-16(23)21-15-9-12(22(25)26)5-8-14(15)20/h3-9H,10H2,1-2H3,(H,21,23)