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

Systemtic Name: 3-chloranylbicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone Openeye Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone CAS Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone IUPAC Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone Traditional Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; cyclohexanone Formula: C13H15ClO MolecularWeight: 222.7106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)CC1.C1C2=CC(=C1C=C2)Cl

Isomeric SMILES

C1CCC(=O)CC1.C1C2=CC(=C1C=C2)Cl

InChI

InChI=1S/C7H5Cl.C6H10O/c8-7-4-5-1-2-6(7)3-5;7-6-4-2-1-3-5-6/h1-2,4H,3H2;1-5H2