methyl 1,3-dinitrocyclobutane-1-carboxylate

Systemtic Name: methyl 1,3-dinitrocyclobutane-1-carboxylate Openeye Name: methyl 1,3-dinitrocyclobutanecarboxylate CAS Name: 1,3-dinitro-1-cyclobutanecarboxylic acid methyl ester IUPAC Name: methyl 1,3-dinitrocyclobutane-1-carboxylate Traditional Name: 1,3-dinitrocyclobutanecarboxylic acid methyl ester Formula: C6H8N2O6 MolecularWeight: 204.13752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1(CC(C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H8N2O6/c1-14-5(9)6(8(12)13)2-4(3-6)7(10)11/h4H,2-3H2,1H3