(3-oxidanylidene-5-bicyclo[2.2.1]heptanyl)methyl 3,5-dinitrobenzoate

Systemtic Name: (3-oxidanylidene-5-bicyclo[2.2.1]heptanyl)methyl 3,5-dinitrobenzoate Openeye Name: (6-oxonorbornan-2-yl)methyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (3-oxo-5-bicyclo[2.2.1]heptanyl)methyl ester IUPAC Name: (3-oxo-5-bicyclo[2.2.1]heptanyl)methyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (6-ketonorbornan-2-yl)methyl ester Formula: C15H14N2O7 MolecularWeight: 334.28086

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(C1COC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)C2

Isomeric SMILES

C1C2CC(C1COC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)C2

InChI

InChI=1S/C15H14N2O7/c18-14-3-8-1-10(13(14)2-8)7-24-15(19)9-4-11(16(20)21)6-12(5-9)17(22)23/h4-6,8,10,13H,1-3,7H2