2-[2,5-bis(chloranyl)phenoxy]-1-imidazol-1-yl-4,4-dimethyl-pentan-3-one hydrochloride

Systemtic Name: 2-[2,5-bis(chloranyl)phenoxy]-1-imidazol-1-yl-4,4-dimethyl-pentan-3-one hydrochloride Openeye Name: 2-(2,5-dichlorophenoxy)-1-imidazol-1-yl-4,4-dimethyl-pentan-3-one hydrochloride CAS Name: 2-(2,5-dichlorophenoxy)-1-(1-imidazolyl)-4,4-dimethyl-3-pentanone hydrochloride IUPAC Name: 2-(2,5-dichlorophenoxy)-1-imidazol-1-yl-4,4-dimethylpentan-3-one hydrochloride Traditional Name: 2-(2,5-dichlorophenoxy)-1-imidazol-1-yl-4,4-dimethyl-pentan-3-one hydrochloride Formula: C16H19Cl3N2O2 MolecularWeight: 377.69326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CN1C=CN=C1)OC2=C(C=CC(=C2)Cl)Cl.Cl

Isomeric SMILES

CC(C)(C)C(=O)C(CN1C=CN=C1)OC2=C(C=CC(=C2)Cl)Cl.Cl

InChI

InChI=1S/C16H18Cl2N2O2.ClH/c1-16(2,3)15(21)14(9-20-7-6-19-10-20)22-13-8-11(17)4-5-12(13)18;/h4-8,10,14H,9H2,1-3H3;1H