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

Systemtic Name: 3-methylbutyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: isopentyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid isoamyl ester Formula: C15H17F3O2 MolecularWeight: 286.28949

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17F3O2/c1-11(2)8-9-20-14(19)7-6-12-4-3-5-13(10-12)15(16,17)18/h3-7,10-11H,8-9H2,1-2H3/b7-6+