3-cyano-3-thiophen-2-yl-pentanedioic acid

Systemtic Name: 3-cyano-3-thiophen-2-yl-pentanedioic acid Openeye Name: 3-cyano-3-(2-thienyl)pentanedioic acid CAS Name: 3-cyano-3-thiophen-2-ylpentanedioic acid IUPAC Name: 3-cyano-3-thiophen-2-ylpentanedioic acid Traditional Name: 3-cyano-3-(2-thienyl)glutaric acid Formula: C10H9NO4S MolecularWeight: 239.24776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)(CC(=O)O)C#N

Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)(CC(=O)O)C#N

InChI

InChI=1S/C10H9NO4S/c11-6-10(4-8(12)13,5-9(14)15)7-2-1-3-16-7/h1-3H,4-5H2,(H,12,13)(H,14,15)