1-(3-phenoxyphenyl)prop-2-ynyl (E)-5-chloranyl-2-propan-2-yl-3-(trifluoromethyl)pent-4-enoate

Systemtic Name: 1-(3-phenoxyphenyl)prop-2-ynyl (E)-5-chloranyl-2-propan-2-yl-3-(trifluoromethyl)pent-4-enoate Openeye Name: 1-(3-phenoxyphenyl)prop-2-ynyl (E)-5-chloro-2-isopropyl-3-(trifluoromethyl)pent-4-enoate CAS Name: (E)-5-chloro-2-propan-2-yl-3-(trifluoromethyl)-4-pentenoic acid 1-(3-phenoxyphenyl)prop-2-ynyl ester IUPAC Name: 1-(3-phenoxyphenyl)prop-2-ynyl (E)-5-chloro-2-propan-2-yl-3-(trifluoromethyl)pent-4-enoate Traditional Name: (E)-5-chloro-2-isopropyl-3-(trifluoromethyl)pent-4-enoic acid 1-(3-phenoxyphenyl)prop-2-ynyl ester Formula: C24H22ClF3O3 MolecularWeight: 450.87789

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C=CCl)C(F)(F)F)C(=O)OC(C#C)C1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(/C=C/Cl)C(F)(F)F)C(=O)OC(C#C)C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C24H22ClF3O3/c1-4-21(17-9-8-12-19(15-17)30-18-10-6-5-7-11-18)31-23(29)22(16(2)3)20(13-14-25)24(26,27)28/h1,5-16,20-22H,2-3H3/b14-13+