(1R,3S)-2,2-dimethyl-3-[(E)-3-oxidanylidene-3-[2,2,2-tris(fluoranyl)ethoxy]prop-1-enyl]-1-[1-(3-phenoxyphenyl)prop-2-ynyl]cyclopropane-1-carboxylate

Systemtic Name: (1R,3S)-2,2-dimethyl-3-[(E)-3-oxidanylidene-3-[2,2,2-tris(fluoranyl)ethoxy]prop-1-enyl]-1-[1-(3-phenoxyphenyl)prop-2-ynyl]cyclopropane-1-carboxylate Openeye Name: (1R,3S)-2,2-dimethyl-3-[(E)-3-oxo-3-(2,2,2-trifluoroethoxy)prop-1-enyl]-1-[1-(3-phenoxyphenyl)prop-2-ynyl]cyclopropanecarboxylate CAS Name: (1R,3S)-2,2-dimethyl-3-[(E)-3-oxo-3-(2,2,2-trifluoroethoxy)prop-1-enyl]-1-[1-(3-phenoxyphenyl)prop-2-ynyl]-1-cyclopropanecarboxylate IUPAC Name: (1R,3S)-2,2-dimethyl-3-[(E)-3-oxo-3-(2,2,2-trifluoroethoxy)prop-1-enyl]-1-[1-(3-phenoxyphenyl)prop-2-ynyl]cyclopropane-1-carboxylate Traditional Name: (1R,3S)-3-[(E)-3-keto-3-(2,2,2-trifluoroethoxy)prop-1-enyl]-2,2-dimethyl-1-[1-(3-phenoxyphenyl)prop-2-ynyl]cyclopropanecarboxylate Formula: C26H22F3O5- MolecularWeight: 471.44509

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C(C#C)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])C=CC(=O)OCC(F)(F)F)C

Isomeric SMILES

CC1([C@@H]([C@]1(C(C#C)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])/C=C/C(=O)OCC(F)(F)F)C

InChI

InChI=1S/C26H23F3O5/c1-4-20(17-9-8-12-19(15-17)34-18-10-6-5-7-11-18)26(23(31)32)21(24(26,2)3)13-14-22(30)33-16-25(27,28)29/h1,5-15,20-21H,16H2,2-3H3,(H,31,32)/p-1/b14-13+/t20?,21-,26+/m0/s1