2-[2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(4-methylphenoxy)-2-oxidanyl-propoxy]-2-oxidanylidene-ethanoate

Systemtic Name: 2-[2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(4-methylphenoxy)-2-oxidanyl-propoxy]-2-oxidanylidene-ethanoate Openeye Name: 2-[2-(2,4-dichlorophenyl)-2-hydroxy-1-imidazol-1-yl-3-(4-methylphenoxy)propoxy]-2-oxo-acetate CAS Name: 2-[2-(2,4-dichlorophenyl)-2-hydroxy-1-(1-imidazolyl)-3-(4-methylphenoxy)propoxy]-2-oxoacetate IUPAC Name: 2-[2-(2,4-dichlorophenyl)-2-hydroxy-1-imidazol-1-yl-3-(4-methylphenoxy)propoxy]-2-oxoacetate Traditional Name: 2-[2-(2,4-dichlorophenyl)-2-hydroxy-1-imidazol-1-yl-3-(4-methylphenoxy)propoxy]-2-keto-acetate Formula: C21H17Cl2N2O6- MolecularWeight: 464.27548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(C2=C(C=C(C=C2)Cl)Cl)(C(N3C=CN=C3)OC(=O)C(=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)OCC(C2=C(C=C(C=C2)Cl)Cl)(C(N3C=CN=C3)OC(=O)C(=O)[O-])O

InChI

InChI=1S/C21H18Cl2N2O6/c1-13-2-5-15(6-3-13)30-11-21(29,16-7-4-14(22)10-17(16)23)20(25-9-8-24-12-25)31-19(28)18(26)27/h2-10,12,20,29H,11H2,1H3,(H,26,27)/p-1