2-[5-(4-chlorophenyl)pyridin-2-yl]piperazine-1-carboxylic acid

Systemtic Name: 2-[5-(4-chlorophenyl)pyridin-2-yl]piperazine-1-carboxylic acid Openeye Name: 2-[5-(4-chlorophenyl)-2-pyridyl]piperazine-1-carboxylic acid CAS Name: 2-[5-(4-chlorophenyl)-2-pyridinyl]-1-piperazinecarboxylic acid IUPAC Name: 2-[5-(4-chlorophenyl)pyridin-2-yl]piperazine-1-carboxylic acid Traditional Name: 2-[5-(4-chlorophenyl)-2-pyridyl]piperazine-1-carboxylic acid Formula: C16H16ClN3O2 MolecularWeight: 317.77014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C2=NC=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1CN(C(CN1)C2=NC=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H16ClN3O2/c17-13-4-1-11(2-5-13)12-3-6-14(19-9-12)15-10-18-7-8-20(15)16(21)22/h1-6,9,15,18H,7-8,10H2,(H,21,22)