ethyl 2-[4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)vinyl]phenoxy]acetate CAS Name: 2-[4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)vinyl]phenoxy]acetic acid ethyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C=C(C#N)C2=NC3=C(N2)C=C(C(=C3)C)C

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=C(N2)C=C(C(=C3)C)C

InChI

InChI=1S/C22H21N3O3/c1-4-27-21(26)13-28-18-7-5-16(6-8-18)11-17(12-23)22-24-19-9-14(2)15(3)10-20(19)25-22/h5-11H,4,13H2,1-3H3,(H,24,25)/b17-11+