2-(1,3-dithian-2-ylidene)-3-oxidanylidene-butanoic acid

Systemtic Name: 2-(1,3-dithian-2-ylidene)-3-oxidanylidene-butanoic acid Openeye Name: 2-(1,3-dithian-2-ylidene)-3-oxo-butanoic acid CAS Name: 2-(1,3-dithian-2-ylidene)-3-oxobutanoic acid IUPAC Name: 2-(1,3-dithian-2-ylidene)-3-oxobutanoic acid Traditional Name: 2-(1,3-dithian-2-ylidene)-3-keto-butyric acid Formula: C8H10O3S2 MolecularWeight: 218.2932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1SCCCS1)C(=O)O

Isomeric SMILES

CC(=O)C(=C1SCCCS1)C(=O)O

InChI

InChI=1S/C8H10O3S2/c1-5(9)6(7(10)11)8-12-3-2-4-13-8/h2-4H2,1H3,(H,10,11)