3-nitro-1-(3-oxidanylpentyl)-N-pentyl-pyrazole-4-carboxamide

Systemtic Name: 3-nitro-1-(3-oxidanylpentyl)-N-pentyl-pyrazole-4-carboxamide Openeye Name: 1-(3-hydroxypentyl)-3-nitro-N-pentyl-pyrazole-4-carboxamide CAS Name: 1-(3-hydroxypentyl)-3-nitro-N-pentyl-4-pyrazolecarboxamide IUPAC Name: 1-(3-hydroxypentyl)-3-nitro-N-pentylpyrazole-4-carboxamide Traditional Name: N-amyl-1-(3-hydroxypentyl)-3-nitro-pyrazole-4-carboxamide Formula: C14H24N4O4 MolecularWeight: 312.36476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CN(N=C1[N+](=O)[O-])CCC(CC)O

Isomeric SMILES

CCCCCNC(=O)C1=CN(N=C1[N+](=O)[O-])CCC(CC)O

InChI

InChI=1S/C14H24N4O4/c1-3-5-6-8-15-14(20)12-10-17(9-7-11(19)4-2)16-13(12)18(21)22/h10-11,19H,3-9H2,1-2H3,(H,15,20)