N-[2-(hydroxymethyl)-1-(4-octylsulfanylphenyl)-3-oxidanyl-propan-2-yl]ethanamide

Systemtic Name: N-[2-(hydroxymethyl)-1-(4-octylsulfanylphenyl)-3-oxidanyl-propan-2-yl]ethanamide Openeye Name: N-[1,1-bis(hydroxymethyl)-2-(4-octylsulfanylphenyl)ethyl]acetamide CAS Name: N-[1-hydroxy-2-(hydroxymethyl)-3-[4-(octylthio)phenyl]propan-2-yl]acetamide IUPAC Name: N-[1-hydroxy-2-(hydroxymethyl)-3-(4-octylsulfanylphenyl)propan-2-yl]acetamide Traditional Name: N-[1,1-dimethylol-2-[4-(octylthio)phenyl]ethyl]acetamide Formula: C20H33NO3S MolecularWeight: 367.54592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=CC=C(C=C1)CC(CO)(CO)NC(=O)C

Isomeric SMILES

CCCCCCCCSC1=CC=C(C=C1)CC(CO)(CO)NC(=O)C

InChI

InChI=1S/C20H33NO3S/c1-3-4-5-6-7-8-13-25-19-11-9-18(10-12-19)14-20(15-22,16-23)21-17(2)24/h9-12,22-23H,3-8,13-16H2,1-2H3,(H,21,24)