(2E,4E)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-4-[3-(trifluoromethyl)phenyl]penta-2,4-dienoate

Systemtic Name: (2E,4E)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-4-[3-(trifluoromethyl)phenyl]penta-2,4-dienoate Openeye Name: (2E,4E)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-4-[3-(trifluoromethyl)phenyl]penta-2,4-dienoate CAS Name: (2E,4E)-5-[4-(1-adamantyl)-3-methoxyphenyl]-4-[3-(trifluoromethyl)phenyl]penta-2,4-dienoate IUPAC Name: (2E,4E)-5-[4-(1-adamantyl)-3-methoxyphenyl]-4-[3-(trifluoromethyl)phenyl]penta-2,4-dienoate Traditional Name: (2E,4E)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-4-[3-(trifluoromethyl)phenyl]penta-2,4-dienoate Formula: C29H28F3O3- MolecularWeight: 481.52603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C=CC(=O)[O-])C2=CC(=CC=C2)C(F)(F)F)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C=C\C(=O)[O-])/C2=CC(=CC=C2)C(F)(F)F)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H29F3O3/c1-35-26-13-18(5-7-25(26)28-15-19-9-20(16-28)11-21(10-19)17-28)12-23(6-8-27(33)34)22-3-2-4-24(14-22)29(30,31)32/h2-8,12-14,19-21H,9-11,15-17H2,1H3,(H,33,34)/p-1/b8-6+,23-12+