2-(2-carboxyethylsulfanylmethyl)icosanoic acid

Systemtic Name: 2-(2-carboxyethylsulfanylmethyl)icosanoic acid Openeye Name: 2-(2-carboxyethylsulfanylmethyl)icosanoic acid CAS Name: 2-[(2-carboxyethylthio)methyl]eicosanoic acid IUPAC Name: 2-(2-carboxyethylsulfanylmethyl)icosanoic acid Traditional Name: 2-[(2-carboxyethylthio)methyl]arachidic acid Formula: C24H46O4S MolecularWeight: 430.68464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CSCCC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CSCCC(=O)O)C(=O)O

InChI

InChI=1S/C24H46O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24(27)28)21-29-20-19-23(25)26/h22H,2-21H2,1H3,(H,25,26)(H,27,28)