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

Systemtic Name: 3-cyclohexyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione Openeye Name: 3-cyclohexyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione CAS Name: 3-cyclohexyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione IUPAC Name: 3-cyclohexyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-dione Traditional Name: 3-cyclohexyl-5-(4-nitrophenyl)-3-azabicyclo[3.1.1]heptane-2,4-quinone Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3CC(C3)(C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3CC(C3)(C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4/c21-16-12-10-18(11-12,13-6-8-15(9-7-13)20(23)24)17(22)19(16)14-4-2-1-3-5-14/h6-9,12,14H,1-5,10-11H2