(2R)-2-[2-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-6-methoxy-phenoxy]propanoate

Systemtic Name: (2R)-2-[2-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-6-methoxy-phenoxy]propanoate Openeye Name: (2R)-2-[2-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-6-methoxy-phenoxy]propanoate CAS Name: (2R)-2-[2-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-6-methoxyphenoxy]propanoate IUPAC Name: (2R)-2-[2-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-6-methoxyphenoxy]propanoate Traditional Name: (2R)-2-[2-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-6-methoxy-phenoxy]propionate Formula: C20H16N3O4- MolecularWeight: 362.35874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])OC1=C(C=CC=C1OC)C=C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

C[C@H](C(=O)[O-])OC1=C(C=CC=C1OC)/C=C(/C#N)\C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H17N3O4/c1-12(20(24)25)27-18-13(6-5-9-17(18)26-2)10-14(11-21)19-22-15-7-3-4-8-16(15)23-19/h3-10,12H,1-2H3,(H,22,23)(H,24,25)/p-1/b14-10-/t12-/m1/s1