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

Systemtic Name: O3-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(4-chloro-3-nitro-anilino)-2-oxo-1-phenyl-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-chloro-3-nitro-anilino)-2-keto-1-phenyl-ethyl] ester O1-methyl ester Formula: C23H16ClN3O9 MolecularWeight: 513.84084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H16ClN3O9/c1-35-22(29)14-9-15(11-17(10-14)26(31)32)23(30)36-20(13-5-3-2-4-6-13)21(28)25-16-7-8-18(24)19(12-16)27(33)34/h2-12,20H,1H3,(H,25,28)