1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]pyrazole-3-carboxamide Formula: C19H22N8O3 MolecularWeight: 410.42978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)CN4C=NC(=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)CN4C=NC(=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H22N8O3/c28-18(17-8-11-25(22-17)14-26-13-20-19(23-26)27(29)30)21-16-6-4-15(5-7-16)12-24-9-2-1-3-10-24/h4-8,11,13H,1-3,9-10,12,14H2,(H,21,28)