2-chloranyl-3,5,5-trimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-chloranyl-3,5,5-trimethyl-cyclohex-2-en-1-one Openeye Name: 2-chloro-3,5,5-trimethyl-cyclohex-2-en-1-one CAS Name: 2-chloro-3,5,5-trimethyl-1-cyclohex-2-enone IUPAC Name: 2-chloro-3,5,5-trimethylcyclohex-2-en-1-one Traditional Name: 2-chloro-3,5,5-trimethyl-cyclohex-2-en-1-one Formula: C9H13ClO MolecularWeight: 172.65192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC(C1)(C)C)Cl

Isomeric SMILES

CC1=C(C(=O)CC(C1)(C)C)Cl

InChI

InChI=1S/C9H13ClO/c1-6-4-9(2,3)5-7(11)8(6)10/h4-5H2,1-3H3