2-[(4-methylsulfanylphenyl)methylidene]propanedioic acid

Systemtic Name: 2-[(4-methylsulfanylphenyl)methylidene]propanedioic acid Openeye Name: 2-[(4-methylsulfanylphenyl)methylene]propanedioic acid CAS Name: 2-[[4-(methylthio)phenyl]methylidene]propanedioic acid IUPAC Name: 2-[(4-methylsulfanylphenyl)methylidene]propanedioic acid Traditional Name: 2-[4-(methylthio)benzylidene]malonic acid Formula: C11H10O4S MolecularWeight: 238.2597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C(=O)O)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C=C(C(=O)O)C(=O)O

InChI

InChI=1S/C11H10O4S/c1-16-8-4-2-7(3-5-8)6-9(10(12)13)11(14)15/h2-6H,1H3,(H,12,13)(H,14,15)