7-azabicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone

Systemtic Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone Openeye Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone CAS Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone IUPAC Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone Traditional Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone Formula: C12H15NO MolecularWeight: 189.2536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)CC1.C1=CC2=CC=C1N2

Isomeric SMILES

C1CCC(=O)CC1.C1=CC2=CC=C1N2

InChI

InChI=1S/C6H5N.C6H10O/c1-2-6-4-3-5(1)7-6;7-6-4-2-1-3-5-6/h1-4,7H;1-5H2