1-[(4-chloranyl-3-methyl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-chloro-3-methyl-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-chloro-3-methylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-chloro-3-methylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(4-chloro-3-methyl-benzyl)isonipecotic acid Formula: C14H18ClNO2 MolecularWeight: 267.75122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2CCC(CC2)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)CN2CCC(CC2)C(=O)O)Cl

InChI

InChI=1S/C14H18ClNO2/c1-10-8-11(2-3-13(10)15)9-16-6-4-12(5-7-16)14(17)18/h2-3,8,12H,4-7,9H2,1H3,(H,17,18)