(6-methyl-5-bicyclo[4.1.0]heptanyl) 3,5-dinitrobenzoate

Systemtic Name: (6-methyl-5-bicyclo[4.1.0]heptanyl) 3,5-dinitrobenzoate Openeye Name: (1-methylnorcaran-2-yl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (6-methyl-5-bicyclo[4.1.0]heptanyl) ester IUPAC Name: (6-methyl-5-bicyclo[4.1.0]heptanyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (1-methylnorcaran-2-yl) ester Formula: C15H16N2O6 MolecularWeight: 320.29734

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC1CCCC2OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC12CC1CCCC2OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O6/c1-15-8-10(15)3-2-4-13(15)23-14(18)9-5-11(16(19)20)7-12(6-9)17(21)22/h5-7,10,13H,2-4,8H2,1H3