3,5-dinitrocyclohexene-1-carboxylic acid

Systemtic Name: 3,5-dinitrocyclohexene-1-carboxylic acid Openeye Name: 3,5-dinitrocyclohexene-1-carboxylic acid CAS Name: 3,5-dinitro-1-cyclohexenecarboxylic acid IUPAC Name: 3,5-dinitrocyclohexene-1-carboxylic acid Traditional Name: 3,5-dinitrocyclohexene-1-carboxylic acid Formula: C7H8N2O6 MolecularWeight: 216.14822

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=CC1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1C(CC(=CC1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1,5-6H,2-3H2,(H,10,11)