2-[(3-cyanothiophen-2-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(3-cyanothiophen-2-yl)carbamoyl]benzoic acid Openeye Name: 2-[(3-cyano-2-thienyl)carbamoyl]benzoic acid CAS Name: 2-[[(3-cyano-2-thiophenyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(3-cyanothiophen-2-yl)carbamoyl]benzoic acid Traditional Name: 2-[(3-cyano-2-thienyl)carbamoyl]benzoic acid Formula: C13H8N2O3S MolecularWeight: 272.27922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=C(C=CS2)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=C(C=CS2)C#N)C(=O)O

InChI

InChI=1S/C13H8N2O3S/c14-7-8-5-6-19-12(8)15-11(16)9-3-1-2-4-10(9)13(17)18/h1-6H,(H,15,16)(H,17,18)