1-(6-chloranyl-1,3-benzothiazol-2-yl)piperidine-2-carboxylic acid

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)piperidine-2-carboxylic acid Openeye Name: 1-(6-chloro-1,3-benzothiazol-2-yl)piperidine-2-carboxylic acid CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-2-piperidinecarboxylic acid IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)piperidine-2-carboxylic acid Traditional Name: 1-(6-chloro-1,3-benzothiazol-2-yl)pipecolinic acid Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C13H13ClN2O2S/c14-8-4-5-9-11(7-8)19-13(15-9)16-6-2-1-3-10(16)12(17)18/h4-5,7,10H,1-3,6H2,(H,17,18)