2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]phenoxy]ethanoate

Systemtic Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]phenoxy]ethanoate Openeye Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]phenoxy]acetate CAS Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy]acetate IUPAC Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy]acetate Traditional Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]phenoxy]acetate Formula: C18H12N3O3- MolecularWeight: 318.30618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O3/c19-10-13(18-20-14-6-2-3-7-15(14)21-18)9-12-5-1-4-8-16(12)24-11-17(22)23/h1-9H,11H2,(H,20,21)(H,22,23)/p-1/b13-9+