azonane; 2,4,6-trinitrophenol

Systemtic Name: azonane; 2,4,6-trinitrophenol Openeye Name: azonane; picric acid CAS Name: azonane; 2,4,6-trinitrophenol IUPAC Name: azonane; 2,4,6-trinitrophenol Traditional Name: azonane; picric acid Formula: C14H20N4O7 MolecularWeight: 356.3312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCNCCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCCCNCCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H17N.C6H3N3O7/c1-2-4-6-8-9-7-5-3-1;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h9H,1-8H2;1-2,10H