4-azanyl-1-(phenylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 4-azanyl-1-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 4-amino-1-benzyl-piperidine-4-carboxylic acid CAS Name: 4-amino-1-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-amino-1-benzylpiperidine-4-carboxylic acid Traditional Name: 4-amino-1-benzyl-isonipecotic acid Formula: C13H18N2O2 MolecularWeight: 234.29422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)O)N)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1(C(=O)O)N)CC2=CC=CC=C2

InChI

InChI=1S/C13H18N2O2/c14-13(12(16)17)6-8-15(9-7-13)10-11-4-2-1-3-5-11/h1-5H,6-10,14H2,(H,16,17)