4-(sulfanylmethyl)heptanedioic acid

Systemtic Name: 4-(sulfanylmethyl)heptanedioic acid Openeye Name: 4-(sulfanylmethyl)heptanedioic acid CAS Name: 4-(mercaptomethyl)heptanedioic acid IUPAC Name: 4-(sulfanylmethyl)heptanedioic acid Traditional Name: 4-(mercaptomethyl)pimelic acid Formula: C8H14O4S MolecularWeight: 206.25936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(CCC(=O)O)CS

Isomeric SMILES

C(CC(=O)O)C(CCC(=O)O)CS

InChI

InChI=1S/C8H14O4S/c9-7(10)3-1-6(5-13)2-4-8(11)12/h6,13H,1-5H2,(H,9,10)(H,11,12)