[5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] ethanoate Openeye Name: [5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C19H15N3O3 MolecularWeight: 333.3407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OC

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)OC

InChI

InChI=1S/C19H15N3O3/c1-12(23)25-18-10-13(7-8-17(18)24-2)9-14(11-20)19-21-15-5-3-4-6-16(15)22-19/h3-10H,1-2H3,(H,21,22)/b14-9+