(3S)-3-methoxycarbonyl-4-oxidanylidene-3-sulfanyl-pentanoic acid

Systemtic Name: (3S)-3-methoxycarbonyl-4-oxidanylidene-3-sulfanyl-pentanoic acid Openeye Name: (3S)-3-methoxycarbonyl-4-oxo-3-sulfanyl-pentanoic acid CAS Name: (3S)-3-mercapto-3-methoxycarbonyl-4-oxopentanoic acid IUPAC Name: (3S)-3-methoxycarbonyl-4-oxo-3-sulfanylpentanoic acid Traditional Name: (3S)-3-carbomethoxy-4-keto-3-mercapto-valeric acid Formula: C7H10O5S MolecularWeight: 206.2163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(=O)O)(C(=O)OC)S

Isomeric SMILES

CC(=O)[C@@](CC(=O)O)(C(=O)OC)S

InChI

InChI=1S/C7H10O5S/c1-4(8)7(13,3-5(9)10)6(11)12-2/h13H,3H2,1-2H3,(H,9,10)/t7-/m0/s1