2,7-dinitrocubane-1-carboxylic acid

Systemtic Name: 2,7-dinitrocubane-1-carboxylic acid Openeye Name: 2,7-dinitrocubane-1-carboxylic acid CAS Name: 2,7-dinitro-1-cubanecarboxylic acid IUPAC Name: 2,7-dinitrocubane-1-carboxylic acid Traditional Name: 2,7-dinitrocubane-1-carboxylic acid Formula: C9H6N2O6 MolecularWeight: 238.15374

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Descriptors Computed from Structure

Canonical SMILES:

C12C3C4C1(C5C2C3(C45C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C12C3C4C1(C5C2C3(C45C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H6N2O6/c12-6(13)7-4-2-1-3(9(2,7)11(16)17)5(7)8(1,4)10(14)15/h1-5H,(H,12,13)