(E)-3-(phenylmethyl)-3-(trifluoromethyl)non-5-en-2-one

Systemtic Name: (E)-3-(phenylmethyl)-3-(trifluoromethyl)non-5-en-2-one Openeye Name: (E)-3-benzyl-3-(trifluoromethyl)non-5-en-2-one CAS Name: (E)-3-(phenylmethyl)-3-(trifluoromethyl)-5-nonen-2-one IUPAC Name: (E)-3-benzyl-3-(trifluoromethyl)non-5-en-2-one Traditional Name: (E)-3-benzyl-3-(trifluoromethyl)non-5-en-2-one Formula: C17H21F3O MolecularWeight: 298.34325

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CCC(CC1=CC=CC=C1)(C(=O)C)C(F)(F)F

Isomeric SMILES

CCC/C=C/CC(CC1=CC=CC=C1)(C(=O)C)C(F)(F)F

InChI

InChI=1S/C17H21F3O/c1-3-4-5-9-12-16(14(2)21,17(18,19)20)13-15-10-7-6-8-11-15/h5-11H,3-4,12-13H2,1-2H3/b9-5+