(3-methylcyclopentyl) 3,5-dinitrobenzoate

Systemtic Name: (3-methylcyclopentyl) 3,5-dinitrobenzoate Openeye Name: (3-methylcyclopentyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (3-methylcyclopentyl) ester IUPAC Name: (3-methylcyclopentyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (3-methylcyclopentyl) ester Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CCC(C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O6/c1-8-2-3-12(4-8)21-13(16)9-5-10(14(17)18)7-11(6-9)15(19)20/h5-8,12H,2-4H2,1H3