(phenylmethyl) 3-azanyl-4-pyridin-2-yl-piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-azanyl-4-pyridin-2-yl-piperazine-1-carboxylate Openeye Name: benzyl 3-amino-4-(2-pyridyl)piperazine-1-carboxylate CAS Name: 3-amino-4-(2-pyridinyl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-4-pyridin-2-ylpiperazine-1-carboxylate Traditional Name: 3-amino-4-(2-pyridyl)piperazine-1-carboxylic acid benzyl ester Formula: C17H20N4O2 MolecularWeight: 312.3663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)OCC2=CC=CC=C2)N)C3=CC=CC=N3

Isomeric SMILES

C1CN(C(CN1C(=O)OCC2=CC=CC=C2)N)C3=CC=CC=N3

InChI

InChI=1S/C17H20N4O2/c18-15-12-20(10-11-21(15)16-8-4-5-9-19-16)17(22)23-13-14-6-2-1-3-7-14/h1-9,15H,10-13,18H2