[2-[3-[(4-chloranyl-3-methoxy-phenyl)methyl]-5-cyano-2-oxidanylidene-benzimidazol-1-yl]-2-methyl-propyl] ethanoate

Systemtic Name: [2-[3-[(4-chloranyl-3-methoxy-phenyl)methyl]-5-cyano-2-oxidanylidene-benzimidazol-1-yl]-2-methyl-propyl] ethanoate Openeye Name: [2-[3-[(4-chloro-3-methoxy-phenyl)methyl]-5-cyano-2-oxo-benzimidazol-1-yl]-2-methyl-propyl] acetate CAS Name: acetic acid [2-[3-[(4-chloro-3-methoxyphenyl)methyl]-5-cyano-2-oxo-1-benzimidazolyl]-2-methylpropyl] ester IUPAC Name: [2-[3-[(4-chloro-3-methoxyphenyl)methyl]-5-cyano-2-oxobenzimidazol-1-yl]-2-methylpropyl] acetate Traditional Name: acetic acid [2-[3-(4-chloro-3-methoxy-benzyl)-5-cyano-2-keto-benzimidazol-1-yl]-2-methyl-propyl] ester Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(C)N1C2=C(C=C(C=C2)C#N)N(C1=O)CC3=CC(=C(C=C3)Cl)OC

Isomeric SMILES

CC(=O)OCC(C)(C)N1C2=C(C=C(C=C2)C#N)N(C1=O)CC3=CC(=C(C=C3)Cl)OC

InChI

InChI=1S/C22H22ClN3O4/c1-14(27)30-13-22(2,3)26-18-8-6-15(11-24)9-19(18)25(21(26)28)12-16-5-7-17(23)20(10-16)29-4/h5-10H,12-13H2,1-4H3