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

Systemtic Name: 3-nitro-N-[4-(piperidin-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-nitro-N-[4-(1-piperidylmethyl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-nitro-N-[4-(1-piperidinylmethyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-nitro-N-[4-(piperidin-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-nitro-N-[4-(piperidinomethyl)phenyl]-1H-pyrazole-5-carboxamide Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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