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

Systemtic Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-bromanyl-6-methoxy-phenyl] ethanoate Openeye Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-bromo-6-methoxy-phenyl] acetate CAS Name: acetic acid [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-bromo-6-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-bromo-6-methoxyphenyl] acetate Traditional Name: acetic acid [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-bromo-6-methoxy-phenyl] ester Formula: C19H14BrN3O3 MolecularWeight: 412.23676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1Br)C=C(C#N)C2=NC3=CC=CC=C3N2)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1Br)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)OC

InChI

InChI=1S/C19H14BrN3O3/c1-11(24)26-18-14(20)8-12(9-17(18)25-2)7-13(10-21)19-22-15-5-3-4-6-16(15)23-19/h3-9H,1-2H3,(H,22,23)/b13-7+