4,5-dihydro-1H-pyrazole; 2,4,6-trinitrophenol

Systemtic Name: 4,5-dihydro-1H-pyrazole; 2,4,6-trinitrophenol Openeye Name: 4,5-dihydro-1H-pyrazole; picric acid CAS Name: 4,5-dihydro-1H-pyrazole; 2,4,6-trinitrophenol IUPAC Name: 4,5-dihydro-1H-pyrazole; 2,4,6-trinitrophenol Traditional Name: picric acid; 2-pyrazoline Formula: C9H9N5O7 MolecularWeight: 299.19706

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Descriptors Computed from Structure

Canonical SMILES:

C1CNN=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CNN=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H3N3O7.C3H6N2/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;1-2-4-5-3-1/h1-2,10H;2,5H,1,3H2