3-nitro-N-octadecyl-1H-pyrazole-5-carboxamide

Systemtic Name: 3-nitro-N-octadecyl-1H-pyrazole-5-carboxamide Openeye Name: 3-nitro-N-octadecyl-1H-pyrazole-5-carboxamide CAS Name: 3-nitro-N-octadecyl-1H-pyrazole-5-carboxamide IUPAC Name: 3-nitro-N-octadecyl-1H-pyrazole-5-carboxamide Traditional Name: 3-nitro-N-stearyl-1H-pyrazole-5-carboxamide Formula: C22H40N4O3 MolecularWeight: 408.578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=NN1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=NN1)[N+](=O)[O-]

InChI

InChI=1S/C22H40N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-22(27)20-19-21(25-24-20)26(28)29/h19H,2-18H2,1H3,(H,23,27)(H,24,25)