(E)-5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(trifluoromethyl)pent-2-enoate

Systemtic Name: (E)-5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(trifluoromethyl)pent-2-enoate Openeye Name: (E)-5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(trifluoromethyl)pent-2-enoate CAS Name: (E)-5-(4-methoxy-2,3,6-trimethylphenyl)-3-(trifluoromethyl)-2-pentenoate IUPAC Name: (E)-5-(4-methoxy-2,3,6-trimethylphenyl)-3-(trifluoromethyl)pent-2-enoate Traditional Name: (E)-5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(trifluoromethyl)pent-2-enoate Formula: C16H18F3O3- MolecularWeight: 315.30753

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CCC(=CC(=O)[O-])C(F)(F)F)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1CC/C(=C\C(=O)[O-])/C(F)(F)F)C)C)OC

InChI

InChI=1S/C16H19F3O3/c1-9-7-14(22-4)11(3)10(2)13(9)6-5-12(8-15(20)21)16(17,18)19/h7-8H,5-6H2,1-4H3,(H,20,21)/p-1/b12-8+