1-(2-acetamido-4-chloranyl-phenyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(2-acetamido-4-chloranyl-phenyl)piperidine-4-carboxylic acid Openeye Name: 1-(2-acetamido-4-chloro-phenyl)piperidine-4-carboxylic acid CAS Name: 1-(2-acetamido-4-chlorophenyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(2-acetamido-4-chlorophenyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-acetamido-4-chloro-phenyl)isonipecotic acid Formula: C14H17ClN2O3 MolecularWeight: 296.74938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)Cl)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)Cl)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C14H17ClN2O3/c1-9(18)16-12-8-11(15)2-3-13(12)17-6-4-10(5-7-17)14(19)20/h2-3,8,10H,4-7H2,1H3,(H,16,18)(H,19,20)