2-pentadeca-2,5-diynylsulfanylethanoic acid

Systemtic Name: 2-pentadeca-2,5-diynylsulfanylethanoic acid Openeye Name: 2-pentadeca-2,5-diynylsulfanylacetic acid CAS Name: 2-(pentadeca-2,5-diynylthio)acetic acid IUPAC Name: 2-pentadeca-2,5-diynylsulfanylacetic acid Traditional Name: 2-(pentadeca-2,5-diynylthio)acetic acid Formula: C17H26O2S MolecularWeight: 294.45214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC#CCC#CCSCC(=O)O

Isomeric SMILES

CCCCCCCCCC#CCC#CCSCC(=O)O

InChI

InChI=1S/C17H26O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-17(18)19/h2-9,12,15-16H2,1H3,(H,18,19)