methyl 2-[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]phenoxy]acetate CAS Name: 2-[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]phenoxy]acetic acid methyl ester Formula: C19H15N3O3 MolecularWeight: 333.3407

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H15N3O3/c1-24-18(23)12-25-15-8-6-13(7-9-15)10-14(11-20)19-21-16-4-2-3-5-17(16)22-19/h2-10H,12H2,1H3,(H,21,22)/b14-10+