heptadecyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: heptadecyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: heptadecyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid heptadecyl ester IUPAC Name: heptadecyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid heptadecyl ester Formula: C27H41F3O2 MolecularWeight: 454.60845

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C27H41F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-32-26(31)21-20-24-18-17-19-25(23-24)27(28,29)30/h17-21,23H,2-16,22H2,1H3/b21-20+