4-chloranyl-2-methyl-3,5-dinitro-cyclohexane-1-carboxylic acid

Systemtic Name: 4-chloranyl-2-methyl-3,5-dinitro-cyclohexane-1-carboxylic acid Openeye Name: 4-chloro-2-methyl-3,5-dinitro-cyclohexanecarboxylic acid CAS Name: 4-chloro-2-methyl-3,5-dinitro-1-cyclohexanecarboxylic acid IUPAC Name: 4-chloro-2-methyl-3,5-dinitrocyclohexane-1-carboxylic acid Traditional Name: 4-chloro-2-methyl-3,5-dinitro-cyclohexanecarboxylic acid Formula: C8H11ClN2O6 MolecularWeight: 266.63574

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(C(C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1C(CC(C(C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C8H11ClN2O6/c1-3-4(8(12)13)2-5(10(14)15)6(9)7(3)11(16)17/h3-7H,2H2,1H3,(H,12,13)