methyl 6,6-bis[3-bromanyl-4-methoxy-5-(trifluoromethyl)phenyl]hex-5-enoate

Systemtic Name: methyl 6,6-bis[3-bromanyl-4-methoxy-5-(trifluoromethyl)phenyl]hex-5-enoate Openeye Name: methyl 6,6-bis[3-bromo-4-methoxy-5-(trifluoromethyl)phenyl]hex-5-enoate CAS Name: 6,6-bis[3-bromo-4-methoxy-5-(trifluoromethyl)phenyl]-5-hexenoic acid methyl ester IUPAC Name: methyl 6,6-bis[3-bromo-4-methoxy-5-(trifluoromethyl)phenyl]hex-5-enoate Traditional Name: 6,6-bis[3-bromo-4-methoxy-5-(trifluoromethyl)phenyl]hex-5-enoic acid methyl ester Formula: C23H20Br2F6O4 MolecularWeight: 634.200919

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C(=CCCCC(=O)OC)C2=CC(=C(C(=C2)Br)OC)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1Br)C(=CCCCC(=O)OC)C2=CC(=C(C(=C2)Br)OC)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C23H20Br2F6O4/c1-33-19(32)7-5-4-6-14(12-8-15(22(26,27)28)20(34-2)17(24)10-12)13-9-16(23(29,30)31)21(35-3)18(25)11-13/h6,8-11H,4-5,7H2,1-3H3