2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-6-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-6-methoxy-phenoxy]ethanoate Openeye Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-6-methoxy-phenoxy]acetate CAS Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-6-methoxyphenoxy]acetate IUPAC Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-6-methoxyphenoxy]acetate Traditional Name: 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-6-methoxy-phenoxy]acetate Formula: C19H14N3O4- MolecularWeight: 348.33216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC(=O)[O-])C=C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC1=CC=CC(=C1OCC(=O)[O-])/C=C(\C#N)/C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H15N3O4/c1-25-16-8-4-5-12(18(16)26-11-17(23)24)9-13(10-20)19-21-14-6-2-3-7-15(14)22-19/h2-9H,11H2,1H3,(H,21,22)(H,23,24)/p-1/b13-9+