[(E,3S,4R)-1-phenyl-7-phenylmethoxy-4-(trifluoromethyl)hept-1-en-5-yn-3-yl] ethanoate

Systemtic Name: [(E,3S,4R)-1-phenyl-7-phenylmethoxy-4-(trifluoromethyl)hept-1-en-5-yn-3-yl] ethanoate Openeye Name: [(1S,2R)-5-benzyloxy-1-[(E)-styryl]-2-(trifluoromethyl)pent-3-ynyl] acetate CAS Name: acetic acid [(E,3S,4R)-1-phenyl-7-phenylmethoxy-4-(trifluoromethyl)hept-1-en-5-yn-3-yl] ester IUPAC Name: [(E,3S,4R)-1-phenyl-7-phenylmethoxy-4-(trifluoromethyl)hept-1-en-5-yn-3-yl] acetate Traditional Name: acetic acid [(1S,2R)-5-benzoxy-1-[(E)-styryl]-2-(trifluoromethyl)pent-3-ynyl] ester Formula: C23H21F3O3 MolecularWeight: 402.40625

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C=CC1=CC=CC=C1)C(C#CCOCC2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CC(=O)O[C@@H](/C=C/C1=CC=CC=C1)[C@@H](C#CCOCC2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C23H21F3O3/c1-18(27)29-22(15-14-19-9-4-2-5-10-19)21(23(24,25)26)13-8-16-28-17-20-11-6-3-7-12-20/h2-7,9-12,14-15,21-22H,16-17H2,1H3/b15-14+/t21-,22+/m1/s1