3-(3-octadecoxypropylsulfanyl)-2-phenylmethoxy-propan-1-ol

Systemtic Name: 3-(3-octadecoxypropylsulfanyl)-2-phenylmethoxy-propan-1-ol Openeye Name: 2-benzyloxy-3-(3-octadecoxypropylsulfanyl)propan-1-ol CAS Name: 3-(3-octadecoxypropylthio)-2-phenylmethoxy-1-propanol IUPAC Name: 3-(3-octadecoxypropylsulfanyl)-2-phenylmethoxypropan-1-ol Traditional Name: 2-benzoxy-3-(3-stearyloxypropylthio)propan-1-ol Formula: C31H56O3S MolecularWeight: 508.83954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCCSCC(CO)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCCSCC(CO)OCC1=CC=CC=C1

InChI

InChI=1S/C31H56O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-33-25-21-26-35-29-31(27-32)34-28-30-22-18-17-19-23-30/h17-19,22-23,31-32H,2-16,20-21,24-29H2,1H3