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

Systemtic Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-5-bromanyl-2-methoxy-phenyl] ethanoate Openeye Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-5-bromo-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-5-bromo-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-5-bromo-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-5-bromo-2-methoxy-phenyl] ester Formula: C19H14BrN3O3 MolecularWeight: 412.23676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14BrN3O3/c1-11(24)26-18-9-14(20)12(8-17(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+