2-[3-(tert-butylamino)-2-oxidanyl-propoxy]benzoic acid hydrochloride

Systemtic Name: 2-[3-(tert-butylamino)-2-oxidanyl-propoxy]benzoic acid hydrochloride Openeye Name: 2-[3-(tert-butylamino)-2-hydroxy-propoxy]benzoic acid hydrochloride CAS Name: 2-[3-(tert-butylamino)-2-hydroxypropoxy]benzoic acid hydrochloride IUPAC Name: 2-[3-(tert-butylamino)-2-hydroxypropoxy]benzoic acid hydrochloride Traditional Name: 2-[3-(tert-butylamino)-2-hydroxy-propoxy]benzoic acid hydrochloride Formula: C14H22ClNO4 MolecularWeight: 303.78178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC=C1C(=O)O)O.Cl

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC=C1C(=O)O)O.Cl

InChI

InChI=1S/C14H21NO4.ClH/c1-14(2,3)15-8-10(16)9-19-12-7-5-4-6-11(12)13(17)18;/h4-7,10,15-16H,8-9H2,1-3H3,(H,17,18);1H