[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,4,5-trimethylfuran-3-carboxylate

Systemtic Name: [2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,4,5-trimethylfuran-3-carboxylate Openeye Name: [2-(2-methoxy-5-nitro-anilino)-2-oxo-ethyl] 2,4,5-trimethylfuran-3-carboxylate CAS Name: 2,4,5-trimethyl-3-furancarboxylic acid [2-(2-methoxy-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxy-5-nitroanilino)-2-oxoethyl] 2,4,5-trimethylfuran-3-carboxylate Traditional Name: 2,4,5-trimethylfuran-3-carboxylic acid [2-keto-2-(2-methoxy-5-nitro-anilino)ethyl] ester Formula: C17H18N2O7 MolecularWeight: 362.33402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O7/c1-9-10(2)26-11(3)16(9)17(21)25-8-15(20)18-13-7-12(19(22)23)5-6-14(13)24-4/h5-7H,8H2,1-4H3,(H,18,20)