O1-methyl O3-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-oxo-2-(4-phenylazoanilino)ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: 1-O-methyl 3-O-[2-oxo-2-(4-phenyldiazenylanilino)ethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-keto-2-(4-phenylazoanilino)ethyl] ester O1-methyl ester Formula: C23H18N4O7 MolecularWeight: 462.41162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3

InChI

InChI=1S/C23H18N4O7/c1-33-22(29)15-11-16(13-20(12-15)27(31)32)23(30)34-14-21(28)24-17-7-9-19(10-8-17)26-25-18-5-3-2-4-6-18/h2-13H,14H2,1H3,(H,24,28)