[3-ethyl-1-(octadecylsulfanylmethyl)pyrrolidin-3-yl]methanol

Systemtic Name: [3-ethyl-1-(octadecylsulfanylmethyl)pyrrolidin-3-yl]methanol Openeye Name: [3-ethyl-1-(octadecylsulfanylmethyl)pyrrolidin-3-yl]methanol CAS Name: [3-ethyl-1-[(octadecylthio)methyl]-3-pyrrolidinyl]methanol IUPAC Name: [3-ethyl-1-(octadecylsulfanylmethyl)pyrrolidin-3-yl]methanol Traditional Name: [3-ethyl-1-[(stearylthio)methyl]pyrrolidin-3-yl]methanol Formula: C26H53NOS MolecularWeight: 427.77012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSCN1CCC(C1)(CC)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSCN1CCC(C1)(CC)CO

InChI

InChI=1S/C26H53NOS/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-29-25-27-21-20-26(4-2,23-27)24-28/h28H,3-25H2,1-2H3