4-but-3-en-2-yl-2-methyl-5-(trifluoromethyl)benzoyl chloride

Systemtic Name: 4-but-3-en-2-yl-2-methyl-5-(trifluoromethyl)benzoyl chloride Openeye Name: 2-methyl-4-(1-methylallyl)-5-(trifluoromethyl)benzoyl chloride CAS Name: 4-but-3-en-2-yl-2-methyl-5-(trifluoromethyl)benzoyl chloride IUPAC Name: 4-but-3-en-2-yl-2-methyl-5-(trifluoromethyl)benzoyl chloride Traditional Name: 2-methyl-4-(1-methylallyl)-5-(trifluoromethyl)benzoyl chloride Formula: C13H12ClF3O MolecularWeight: 276.68199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)Cl)C(F)(F)F)C(C)C=C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)Cl)C(F)(F)F)C(C)C=C

InChI

InChI=1S/C13H12ClF3O/c1-4-7(2)9-5-8(3)10(12(14)18)6-11(9)13(15,16)17/h4-7H,1H2,2-3H3