2-(5-methyl-4-nitro-pyrazol-1-yl)-N-octadecyl-ethanamide

Systemtic Name: 2-(5-methyl-4-nitro-pyrazol-1-yl)-N-octadecyl-ethanamide Openeye Name: 2-(5-methyl-4-nitro-pyrazol-1-yl)-N-octadecyl-acetamide CAS Name: 2-(5-methyl-4-nitro-1-pyrazolyl)-N-octadecylacetamide IUPAC Name: 2-(5-methyl-4-nitropyrazol-1-yl)-N-octadecylacetamide Traditional Name: 2-(5-methyl-4-nitro-pyrazol-1-yl)-N-stearyl-acetamide Formula: C24H44N4O3 MolecularWeight: 436.63116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)CN1C(=C(C=N1)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)CN1C(=C(C=N1)[N+](=O)[O-])C

InChI

InChI=1S/C24H44N4O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-24(29)21-27-22(2)23(20-26-27)28(30)31/h20H,3-19,21H2,1-2H3,(H,25,29)