O3-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxo-propyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[3-cyano-3-(1,3-dimethyl-2-benzimidazolylidene)-2-oxopropyl] ester O1-methyl ester IUPAC Name: 3-O-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxopropyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-keto-propyl] ester O1-methyl ester Formula: C22H18N4O7 MolecularWeight: 450.40092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)COC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)COC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C22H18N4O7/c1-24-17-6-4-5-7-18(17)25(2)20(24)16(11-23)19(27)12-33-22(29)14-8-13(21(28)32-3)9-15(10-14)26(30)31/h4-10H,12H2,1-3H3