1-sulfanylethyl (E)-octadec-9-enoate

Systemtic Name: 1-sulfanylethyl (E)-octadec-9-enoate Openeye Name: 1-sulfanylethyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 1-mercaptoethyl ester IUPAC Name: 1-sulfanylethyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 1-mercaptoethyl ester Formula: C20H38O2S MolecularWeight: 342.57952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C)S

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C)S

InChI

InChI=1S/C20H38O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(21)22-19(2)23/h10-11,19,23H,3-9,12-18H2,1-2H3/b11-10+