3-chloranylbicyclo[2.2.1]hepta-1,3,5-triene; 3-methylpent-4-en-2-one

Systemtic Name: 3-chloranylbicyclo[2.2.1]hepta-1,3,5-triene; 3-methylpent-4-en-2-one Openeye Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; 3-methylpent-4-en-2-one CAS Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; 3-methyl-4-penten-2-one IUPAC Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; 3-methylpent-4-en-2-one Traditional Name: 3-chlorobicyclo[2.2.1]hepta-1,3,5-triene; 3-methylpent-4-en-2-one Formula: C13H15ClO MolecularWeight: 222.7106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)C(=O)C.C1C2=CC(=C1C=C2)Cl

Isomeric SMILES

CC(C=C)C(=O)C.C1C2=CC(=C1C=C2)Cl

InChI

InChI=1S/C7H5Cl.C6H10O/c8-7-4-5-1-2-6(7)3-5;1-4-5(2)6(3)7/h1-2,4H,3H2;4-5H,1H2,2-3H3