2,3,7,8-tetrazaspiro[4.4]nonane; 2,4,6-trinitrophenol

Systemtic Name: 2,3,7,8-tetrazaspiro[4.4]nonane; 2,4,6-trinitrophenol Openeye Name: picric acid; 2,3,7,8-tetrazaspiro[4.4]nonane CAS Name: 2,3,7,8-tetrazaspiro[4.4]nonane; 2,4,6-trinitrophenol IUPAC Name: 2,3,7,8-tetrazaspiro[4.4]nonane; 2,4,6-trinitrophenol Traditional Name: picric acid; 2,3,7,8-tetrazaspiro[4.4]nonane Formula: C11H15N7O7 MolecularWeight: 357.2795

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(CNN1)CNNC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C2(CNN1)CNNC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H3N3O7.C5H12N4/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;1-5(2-7-6-1)3-8-9-4-5/h1-2,10H;6-9H,1-4H2