1-(4-ethylsulfanylphenyl)-2-(octylamino)butan-1-ol

Systemtic Name: 1-(4-ethylsulfanylphenyl)-2-(octylamino)butan-1-ol Openeye Name: 1-(4-ethylsulfanylphenyl)-2-(octylamino)butan-1-ol CAS Name: 1-[4-(ethylthio)phenyl]-2-(octylamino)-1-butanol IUPAC Name: 1-(4-ethylsulfanylphenyl)-2-(octylamino)butan-1-ol Traditional Name: 1-[4-(ethylthio)phenyl]-2-(octylamino)butan-1-ol Formula: C20H35NOS MolecularWeight: 337.563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(CC)C(C1=CC=C(C=C1)SCC)O

Isomeric SMILES

CCCCCCCCNC(CC)C(C1=CC=C(C=C1)SCC)O

InChI

InChI=1S/C20H35NOS/c1-4-7-8-9-10-11-16-21-19(5-2)20(22)17-12-14-18(15-13-17)23-6-3/h12-15,19-22H,4-11,16H2,1-3H3