methyl 5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]furan-2-carboxylate Openeye Name: methyl 5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]furan-2-carboxylate CAS Name: 5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-carboxylate Traditional Name: 5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]furan-2-carboxylic acid methyl ester Formula: C16H11N3O3 MolecularWeight: 293.27684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C=C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)C1=CC=C(O1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H11N3O3/c1-21-16(20)14-7-6-11(22-14)8-10(9-17)15-18-12-4-2-3-5-13(12)19-15/h2-8H,1H3,(H,18,19)/b10-8+