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

Systemtic Name: 1-(octylamino)-3-(3-propan-2-ylsulfanylphenoxy)propan-2-ol Openeye Name: 1-(3-isopropylsulfanylphenoxy)-3-(octylamino)propan-2-ol CAS Name: 1-(octylamino)-3-[3-(propan-2-ylthio)phenoxy]-2-propanol IUPAC Name: 1-(octylamino)-3-(3-propan-2-ylsulfanylphenoxy)propan-2-ol Traditional Name: 1-[3-(isopropylthio)phenoxy]-3-(octylamino)propan-2-ol Formula: C20H35NO2S MolecularWeight: 353.5624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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