4-(tert-butylamino)-2-(2-oxidanylpropoxy)-3-(trifluoromethyl)benzenecarboximidamide dihydrochloride

Systemtic Name: 4-(tert-butylamino)-2-(2-oxidanylpropoxy)-3-(trifluoromethyl)benzenecarboximidamide dihydrochloride Openeye Name: 4-(tert-butylamino)-2-(2-hydroxypropoxy)-3-(trifluoromethyl)benzamidine dihydrochloride CAS Name: 4-(tert-butylamino)-2-(2-hydroxypropoxy)-3-(trifluoromethyl)benzenecarboximidamide dihydrochloride IUPAC Name: 4-(tert-butylamino)-2-(2-hydroxypropoxy)-3-(trifluoromethyl)benzenecarboximidamide dihydrochloride Traditional Name: 4-(tert-butylamino)-2-(2-hydroxypropoxy)-3-(trifluoromethyl)benzamidine dihydrochloride Formula: C15H24Cl2F3N3O2 MolecularWeight: 406.27117

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC(=C1C(F)(F)F)NC(C)(C)C)C(=N)N)O.Cl.Cl

Isomeric SMILES

CC(COC1=C(C=CC(=C1C(F)(F)F)NC(C)(C)C)C(=N)N)O.Cl.Cl

InChI

InChI=1S/C15H22F3N3O2.2ClH/c1-8(22)7-23-12-9(13(19)20)5-6-10(21-14(2,3)4)11(12)15(16,17)18;;/h5-6,8,21-22H,7H2,1-4H3,(H3,19,20);2*1H