1-ethyl-5-(4-nitrophenyl)-3-propyl-3-azabicyclo[3.1.1]heptane-2,4-dione

Systemtic Name: 1-ethyl-5-(4-nitrophenyl)-3-propyl-3-azabicyclo[3.1.1]heptane-2,4-dione Openeye Name: 1-ethyl-5-(4-nitrophenyl)-3-propyl-3-azabicyclo[3.1.1]heptane-2,4-dione CAS Name: 1-ethyl-5-(4-nitrophenyl)-3-propyl-3-azabicyclo[3.1.1]heptane-2,4-dione IUPAC Name: 1-ethyl-5-(4-nitrophenyl)-3-propyl-3-azabicyclo[3.1.1]heptane-2,4-dione Traditional Name: 1-ethyl-5-(4-nitrophenyl)-3-propyl-3-azabicyclo[3.1.1]heptane-2,4-quinone Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2(CC(C2)(C1=O)C3=CC=C(C=C3)[N+](=O)[O-])CC

Isomeric SMILES

CCCN1C(=O)C2(CC(C2)(C1=O)C3=CC=C(C=C3)[N+](=O)[O-])CC

InChI

InChI=1S/C17H20N2O4/c1-3-9-18-14(20)16(4-2)10-17(11-16,15(18)21)12-5-7-13(8-6-12)19(22)23/h5-8H,3-4,9-11H2,1-2H3