O4-[2-[(2-chloranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[2-[(2-chloranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[2-(2-chloro-5-nitro-anilino)-2-oxo-ethyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[2-(2-chloro-5-nitroanilino)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 4-O-[2-(2-chloro-5-nitroanilino)-2-oxoethyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-(2-chloro-5-nitro-anilino)-2-keto-ethyl] ester O1-methyl ester Formula: C17H13ClN2O7 MolecularWeight: 392.74732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13ClN2O7/c1-26-16(22)10-2-4-11(5-3-10)17(23)27-9-15(21)19-14-8-12(20(24)25)6-7-13(14)18/h2-8H,9H2,1H3,(H,19,21)