1-(5-chloranyl-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(5-chloranyl-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid Openeye Name: 1-(5-chloro-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid CAS Name: 1-(5-chloro-1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(5-chloro-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid Traditional Name: 1-(5-chloro-1,3-benzoxazol-2-yl)isonipecotic acid Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C13H13ClN2O3/c14-9-1-2-11-10(7-9)15-13(19-11)16-5-3-8(4-6-16)12(17)18/h1-2,7-8H,3-6H2,(H,17,18)