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

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,4,5-trimethylfuran-3-carboxylate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] 2,4,5-trimethylfuran-3-carboxylate CAS Name: 2,4,5-trimethyl-3-furancarboxylic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] 2,4,5-trimethylfuran-3-carboxylate Traditional Name: 2,4,5-trimethylfuran-3-carboxylic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C16H15ClN2O6 MolecularWeight: 366.7531

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN2O6/c1-8-9(2)25-10(3)15(8)16(21)24-7-14(20)18-11-4-5-12(17)13(6-11)19(22)23/h4-6H,7H2,1-3H3,(H,18,20)