1-phenyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide

Systemtic Name: 1-phenyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide Openeye Name: 1-phenyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide CAS Name: 1-phenyl-N-[[(2R)-2-piperidin-1-iumyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-phenyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide Traditional Name: 1-phenyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide Formula: C16H21N4O+ MolecularWeight: 285.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH2+]C(C1)CNC(=O)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH2+][C@H](C1)CNC(=O)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O/c21-16(18-11-14-6-4-5-9-17-14)13-10-19-20(12-13)15-7-2-1-3-8-15/h1-3,7-8,10,12,14,17H,4-6,9,11H2,(H,18,21)/p+1/t14-/m1/s1