4-nitro-N-[4-(piperidin-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-nitro-N-[4-(piperidin-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 4-nitro-N-[4-(1-piperidylmethyl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 4-nitro-N-[4-(1-piperidinylmethyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-nitro-N-[4-(piperidin-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 4-nitro-N-[4-(piperidinomethyl)phenyl]-1H-pyrazole-5-carboxamide Formula: C16H19N5O3 MolecularWeight: 329.35376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3/c22-16(15-14(21(23)24)10-17-19-15)18-13-6-4-12(5-7-13)11-20-8-2-1-3-9-20/h4-7,10H,1-3,8-9,11H2,(H,17,19)(H,18,22)