ethyl (2E)-2-(1-cyano-2-methoxy-2-oxidanylidene-ethylidene)-1,3-dihydrobenzimidazole-5-carboxylate

Systemtic Name: ethyl (2E)-2-(1-cyano-2-methoxy-2-oxidanylidene-ethylidene)-1,3-dihydrobenzimidazole-5-carboxylate Openeye Name: ethyl (2E)-2-(1-cyano-2-methoxy-2-oxo-ethylidene)-1,3-dihydrobenzimidazole-5-carboxylate CAS Name: (2E)-2-(1-cyano-2-methoxy-2-oxoethylidene)-1,3-dihydrobenzimidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl (2E)-2-(1-cyano-2-methoxy-2-oxoethylidene)-1,3-dihydrobenzimidazole-5-carboxylate Traditional Name: (2E)-2-(1-cyano-2-keto-2-methoxy-ethylidene)-1,3-dihydrobenzimidazole-5-carboxylic acid ethyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC(=C(C#N)C(=O)OC)N2

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N/C(=C(/C#N)\C(=O)OC)/N2

InChI

InChI=1S/C14H13N3O4/c1-3-21-13(18)8-4-5-10-11(6-8)17-12(16-10)9(7-15)14(19)20-2/h4-6,16-17H,3H2,1-2H3/b12-9+