5-[[4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylate

Systemtic Name: 5-[[4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylate Openeye Name: 5-[[4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylate CAS Name: 5-[[4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylate IUPAC Name: 5-[[4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-ethoxy-phenoxy]methyl]-2-furoate Formula: C24H18N3O5- MolecularWeight: 428.41682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC4=CC=C(O4)C(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(/C#N)\C2=NC3=CC=CC=C3N2)OCC4=CC=C(O4)C(=O)[O-]

InChI

InChI=1S/C24H19N3O5/c1-2-30-22-12-15(7-9-20(22)31-14-17-8-10-21(32-17)24(28)29)11-16(13-25)23-26-18-5-3-4-6-19(18)27-23/h3-12H,2,14H2,1H3,(H,26,27)(H,28,29)/p-1/b16-11-