1-(1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylic acid CAS Name: 1-(1,2-benzothiazol-3-yl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(1,2-benzothiazol-3-yl)proline Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NSC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CC(N(C1)C2=NSC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C12H12N2O2S/c15-12(16)9-5-3-7-14(9)11-8-4-1-2-6-10(8)17-13-11/h1-2,4,6,9H,3,5,7H2,(H,15,16)