methyl 3-[(E)-1,2-diphenylethenyl]-3-(trifluoromethyl)heptanoate

Systemtic Name: methyl 3-[(E)-1,2-diphenylethenyl]-3-(trifluoromethyl)heptanoate Openeye Name: methyl 3-[(E)-1,2-diphenylvinyl]-3-(trifluoromethyl)heptanoate CAS Name: 3-[(E)-1,2-diphenylethenyl]-3-(trifluoromethyl)heptanoic acid methyl ester IUPAC Name: methyl 3-[(E)-1,2-diphenylethenyl]-3-(trifluoromethyl)heptanoate Traditional Name: (E)-3-butyl-4,5-diphenyl-3-(trifluoromethyl)pent-4-enoic acid methyl ester Formula: C23H25F3O2 MolecularWeight: 390.43861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OC)(C(=CC1=CC=CC=C1)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CCCCC(CC(=O)OC)(/C(=C/C1=CC=CC=C1)/C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C23H25F3O2/c1-3-4-15-22(23(24,25)26,17-21(27)28-2)20(19-13-9-6-10-14-19)16-18-11-7-5-8-12-18/h5-14,16H,3-4,15,17H2,1-2H3/b20-16+