1-(5-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(5-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid Openeye Name: 1-(5-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid CAS Name: 1-(5-methoxy-1,3-benzothiazol-2-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(5-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxylic acid Traditional Name: 1-(5-methoxy-1,3-benzothiazol-2-yl)isonipecotic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C14H16N2O3S/c1-19-10-2-3-12-11(8-10)15-14(20-12)16-6-4-9(5-7-16)13(17)18/h2-3,8-9H,4-7H2,1H3,(H,17,18)