2,4,5-trimethyl-3-nitro-bicyclo[3.3.1]nonan-9-one

Systemtic Name: 2,4,5-trimethyl-3-nitro-bicyclo[3.3.1]nonan-9-one Openeye Name: 2,4,5-trimethyl-3-nitro-bicyclo[3.3.1]nonan-9-one CAS Name: 2,4,5-trimethyl-3-nitro-9-bicyclo[3.3.1]nonanone IUPAC Name: 2,4,5-trimethyl-3-nitrobicyclo[3.3.1]nonan-9-one Traditional Name: 2,4,5-trimethyl-3-nitro-bicyclo[3.3.1]nonan-9-one Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CCCC(C2=O)(C(C1[N+](=O)[O-])C)C

Isomeric SMILES

CC1C2CCCC(C2=O)(C(C1[N+](=O)[O-])C)C

InChI

InChI=1S/C12H19NO3/c1-7-9-5-4-6-12(3,11(9)14)8(2)10(7)13(15)16/h7-10H,4-6H2,1-3H3