N-hexyl-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-hexyl-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-hexyl-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-hexyl-3-(5-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-hexyl-3-(5-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-hexyl-3-(5-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C13H22N4O3 MolecularWeight: 282.33878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCN1C(=C(C=N1)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCNC(=O)CCN1C(=C(C=N1)[N+](=O)[O-])C

InChI

InChI=1S/C13H22N4O3/c1-3-4-5-6-8-14-13(18)7-9-16-11(2)12(10-15-16)17(19)20/h10H,3-9H2,1-2H3,(H,14,18)