1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-chloro-2-hydroxy-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-chloro-2-hydroxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-hydroxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(5-chloro-2-hydroxy-benzyl)isonipecotic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C13H16ClNO3/c14-11-1-2-12(16)10(7-11)8-15-5-3-9(4-6-15)13(17)18/h1-2,7,9,16H,3-6,8H2,(H,17,18)