3-bicyclo[2.2.1]heptanyl 3,5-dinitrobenzoate

Systemtic Name: 3-bicyclo[2.2.1]heptanyl 3,5-dinitrobenzoate Openeye Name: norbornan-2-yl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 3-bicyclo[2.2.1]heptanyl ester IUPAC Name: 3-bicyclo[2.2.1]heptanyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 2-norbornyl ester Formula: C14H14N2O6 MolecularWeight: 306.27076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC2CC1CC2OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O6/c17-14(22-13-4-8-1-2-9(13)3-8)10-5-11(15(18)19)7-12(6-10)16(20)21/h5-9,13H,1-4H2