2-methyl-4-nitro-N-octadecyl-pyrazole-3-carboxamide

Systemtic Name: 2-methyl-4-nitro-N-octadecyl-pyrazole-3-carboxamide Openeye Name: 2-methyl-4-nitro-N-octadecyl-pyrazole-3-carboxamide CAS Name: 2-methyl-4-nitro-N-octadecyl-3-pyrazolecarboxamide IUPAC Name: 2-methyl-4-nitro-N-octadecylpyrazole-3-carboxamide Traditional Name: 2-methyl-4-nitro-N-stearyl-pyrazole-3-carboxamide Formula: C23H42N4O3 MolecularWeight: 422.60458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=C(C=NN1C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=C(C=NN1C)[N+](=O)[O-]

InChI

InChI=1S/C23H42N4O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-23(28)22-21(27(29)30)20-25-26(22)2/h20H,3-19H2,1-2H3,(H,24,28)