1-(1,3-benzothiazol-6-ylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(1,3-benzothiazol-6-ylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(1,3-benzothiazole-6-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[1,3-benzothiazol-6-yl(oxo)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(1,3-benzothiazole-6-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(1,3-benzothiazole-6-carbonyl)proline Formula: C13H12N2O3S MolecularWeight: 276.31098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)N=CS3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)N=CS3)C(=O)O

InChI

InChI=1S/C13H12N2O3S/c16-12(15-5-1-2-10(15)13(17)18)8-3-4-9-11(6-8)19-7-14-9/h3-4,6-7,10H,1-2,5H2,(H,17,18)