[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Openeye Name: [2-(2-fluoro-5-nitro-anilino)-2-oxo-ethyl] 5-isopropyl-3-methyl-isoxazole-4-carboxylate CAS Name: 3-methyl-5-propan-2-yl-4-isoxazolecarboxylic acid [2-(2-fluoro-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-fluoro-5-nitroanilino)-2-oxoethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Traditional Name: 5-isopropyl-3-methyl-isoxazole-4-carboxylic acid [2-(2-fluoro-5-nitro-anilino)-2-keto-ethyl] ester Formula: C16H16FN3O6 MolecularWeight: 365.313143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)C(C)C

InChI

InChI=1S/C16H16FN3O6/c1-8(2)15-14(9(3)19-26-15)16(22)25-7-13(21)18-12-6-10(20(23)24)4-5-11(12)17/h4-6,8H,7H2,1-3H3,(H,18,21)