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

Systemtic Name: 5-(4-nitrophenyl)-3-prop-2-ynyl-3-azabicyclo[3.1.1]heptane-2,4-dione Openeye Name: 5-(4-nitrophenyl)-3-prop-2-ynyl-3-azabicyclo[3.1.1]heptane-2,4-dione CAS Name: 5-(4-nitrophenyl)-3-prop-2-ynyl-3-azabicyclo[3.1.1]heptane-2,4-dione IUPAC Name: 5-(4-nitrophenyl)-3-prop-2-ynyl-3-azabicyclo[3.1.1]heptane-2,4-dione Traditional Name: 5-(4-nitrophenyl)-3-propargyl-3-azabicyclo[3.1.1]heptane-2,4-quinone Formula: C15H12N2O4 MolecularWeight: 284.26678

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C2CC(C2)(C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C#CCN1C(=O)C2CC(C2)(C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O4/c1-2-7-16-13(18)10-8-15(9-10,14(16)19)11-3-5-12(6-4-11)17(20)21/h1,3-6,10H,7-9H2