O1-methyl O3-[1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: 1-O-methyl 3-O-[1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester O1-methyl ester Formula: C25H22N2O8 MolecularWeight: 478.45078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H22N2O8/c1-16(35-25(30)19-12-18(24(29)33-2)13-21(14-19)27(31)32)23(28)26-20-8-10-22(11-9-20)34-15-17-6-4-3-5-7-17/h3-14,16H,15H2,1-2H3,(H,26,28)