1-(1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid Openeye Name: 1-(1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid CAS Name: 1-(1,3-benzothiazol-2-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid Traditional Name: 1-(1,3-benzothiazol-2-yl)isonipecotic acid Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H14N2O2S/c16-12(17)9-5-7-15(8-6-9)13-14-10-3-1-2-4-11(10)18-13/h1-4,9H,5-8H2,(H,16,17)