dodec-9-ynyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: dodec-9-ynyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: dodec-9-ynyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid dodec-9-ynyl ester IUPAC Name: dodec-9-ynyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid dodec-9-ynyl ester Formula: C22H27F3O2 MolecularWeight: 380.44379

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCCCCCCCOC(=O)C=CC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CCC#CCCCCCCCCOC(=O)/C=C/C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C22H27F3O2/c1-2-3-4-5-6-7-8-9-10-11-17-27-21(26)16-15-19-13-12-14-20(18-19)22(23,24)25/h12-16,18H,2,5-11,17H2,1H3/b16-15+