2-methyloct-5-yn-4-yl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: 2-methyloct-5-yn-4-yl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: 1-isobutylpent-2-ynyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid 2-methyloct-5-yn-4-yl ester IUPAC Name: 2-methyloct-5-yn-4-yl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid 1-isobutylpent-2-ynyl ester Formula: C19H21F3O2 MolecularWeight: 338.36405

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3O2/c1-4-5-9-17(12-14(2)3)24-18(23)11-10-15-7-6-8-16(13-15)19(20,21)22/h6-8,10-11,13-14,17H,4,12H2,1-3H3/b11-10+