4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-2-methyl-1H-isoquinolin-1-ol hydrochloride

Systemtic Name: 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-2-methyl-1H-isoquinolin-1-ol hydrochloride Openeye Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-2-methyl-1H-isoquinolin-1-ol hydrochloride CAS Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-2-methyl-1H-isoquinolin-1-ol hydrochloride IUPAC Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-2-methyl-1H-isoquinolin-1-ol hydrochloride Traditional Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-2-methyl-1H-isoquinolin-1-ol hydrochloride Formula: C17H27ClN2O3 MolecularWeight: 342.86088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CN(C(C2=CC=CC=C21)O)C)O.Cl

Isomeric SMILES

CC(C)(C)NCC(COC1=CN(C(C2=CC=CC=C21)O)C)O.Cl

InChI

InChI=1S/C17H26N2O3.ClH/c1-17(2,3)18-9-12(20)11-22-15-10-19(4)16(21)14-8-6-5-7-13(14)15;/h5-8,10,12,16,18,20-21H,9,11H2,1-4H3;1H