bicyclo[2.2.1]hepta-1,3,5-trien-7-one; 2-cyanoaziridine-1-carboxamide; ethanamide

Systemtic Name: bicyclo[2.2.1]hepta-1,3,5-trien-7-one; 2-cyanoaziridine-1-carboxamide; ethanamide Openeye Name: acetamide; bicyclo[2.2.1]hepta-1,3,5-trien-7-one; 2-cyanoaziridine-1-carboxamide CAS Name: acetamide; 7-bicyclo[2.2.1]hepta-1,3,5-trienone; 2-cyano-1-aziridinecarboxamide IUPAC Name: acetamide; bicyclo[2.2.1]hepta-1,3,5-trien-7-one; 2-cyanoaziridine-1-carboxamide Traditional Name: acetamide; bicyclo[2.2.1]hepta-1,3,5-trien-7-one; 2-cyanoethylenimine-1-carboxamide Formula: C13H14N4O3 MolecularWeight: 274.27526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N.C1C(N1C(=O)N)C#N.C1=CC2=CC=C1C2=O

Isomeric SMILES

CC(=O)N.C1C(N1C(=O)N)C#N.C1=CC2=CC=C1C2=O

InChI

InChI=1S/C7H4O.C4H5N3O.C2H5NO/c8-7-5-1-2-6(7)4-3-5;5-1-3-2-7(3)4(6)8;1-2(3)4/h1-4H;3H,2H2,(H2,6,8);1H3,(H2,3,4)