3-methyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione

Systemtic Name: 3-methyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione Openeye Name: 3-methyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione CAS Name: 3-methyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione IUPAC Name: 3-methyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione Traditional Name: 3-methyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-quinone Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2CC(C2)(C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2CC(C2)(C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O4/c1-14-11(16)8-6-13(7-8,12(14)17)9-2-4-10(5-3-9)15(18)19/h2-5,8H,6-7H2,1H3