2,2-dimethyl-1-[3-(trifluoromethyl)phenyl]but-3-en-1-one

Systemtic Name: 2,2-dimethyl-1-[3-(trifluoromethyl)phenyl]but-3-en-1-one Openeye Name: 2,2-dimethyl-1-[3-(trifluoromethyl)phenyl]but-3-en-1-one CAS Name: 2,2-dimethyl-1-[3-(trifluoromethyl)phenyl]-3-buten-1-one IUPAC Name: 2,2-dimethyl-1-[3-(trifluoromethyl)phenyl]but-3-en-1-one Traditional Name: 2,2-dimethyl-1-[3-(trifluoromethyl)phenyl]but-3-en-1-one Formula: C13H13F3O MolecularWeight: 242.23693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)C(=O)C1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C=C)C(=O)C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C13H13F3O/c1-4-12(2,3)11(17)9-6-5-7-10(8-9)13(14,15)16/h4-8H,1H2,2-3H3