ethyl 5-[(3-methyl-4-nitro-phenyl)carbonylamino]-6-oxidanylidene-2-(trifluoromethyl)pyran-3-carboxylate

Systemtic Name: ethyl 5-[(3-methyl-4-nitro-phenyl)carbonylamino]-6-oxidanylidene-2-(trifluoromethyl)pyran-3-carboxylate Openeye Name: ethyl 5-[(3-methyl-4-nitro-benzoyl)amino]-6-oxo-2-(trifluoromethyl)pyran-3-carboxylate CAS Name: 5-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]-6-oxo-2-(trifluoromethyl)-3-pyrancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-methyl-4-nitrobenzoyl)amino]-6-oxo-2-(trifluoromethyl)pyran-3-carboxylate Traditional Name: 6-keto-5-[(3-methyl-4-nitro-benzoyl)amino]-2-(trifluoromethyl)pyran-3-carboxylic acid ethyl ester Formula: C17H13F3N2O7 MolecularWeight: 414.28953

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=O)C(=C1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(OC(=O)C(=C1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C)C(F)(F)F

InChI

InChI=1S/C17H13F3N2O7/c1-3-28-15(24)10-7-11(16(25)29-13(10)17(18,19)20)21-14(23)9-4-5-12(22(26)27)8(2)6-9/h4-7H,3H2,1-2H3,(H,21,23)