1-(octylamino)-3-(4-propan-2-ylsulfanylphenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-(octylamino)-3-(4-propan-2-ylsulfanylphenoxy)propan-2-ol hydrochloride Openeye Name: 1-(4-isopropylsulfanylphenoxy)-3-(octylamino)propan-2-ol hydrochloride CAS Name: 1-(octylamino)-3-[4-(propan-2-ylthio)phenoxy]-2-propanol hydrochloride IUPAC Name: 1-(octylamino)-3-(4-propan-2-ylsulfanylphenoxy)propan-2-ol hydrochloride Traditional Name: 1-[4-(isopropylthio)phenoxy]-3-(octylamino)propan-2-ol hydrochloride Formula: C20H36ClNO2S MolecularWeight: 390.02334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCC(COC1=CC=C(C=C1)SC(C)C)O.Cl

Isomeric SMILES

CCCCCCCCNCC(COC1=CC=C(C=C1)SC(C)C)O.Cl

InChI

InChI=1S/C20H35NO2S.ClH/c1-4-5-6-7-8-9-14-21-15-18(22)16-23-19-10-12-20(13-11-19)24-17(2)3;/h10-13,17-18,21-22H,4-9,14-16H2,1-3H3;1H