6,6-bis(3-bromanyl-4-methoxy-5-methoxycarbonyl-phenyl)hex-5-enoic acid

Systemtic Name: 6,6-bis(3-bromanyl-4-methoxy-5-methoxycarbonyl-phenyl)hex-5-enoic acid Openeye Name: 6,6-bis(3-bromo-4-methoxy-5-methoxycarbonyl-phenyl)hex-5-enoic acid CAS Name: 6,6-bis(3-bromo-4-methoxy-5-methoxycarbonylphenyl)-5-hexenoic acid IUPAC Name: 6,6-bis(3-bromo-4-methoxy-5-methoxycarbonylphenyl)hex-5-enoic acid Traditional Name: 6,6-bis(3-bromo-5-carbomethoxy-4-methoxy-phenyl)hex-5-enoic acid Formula: C24H24Br2O8 MolecularWeight: 600.25056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24Br2O8/c1-31-21-16(23(29)33-3)9-13(11-18(21)25)15(7-5-6-8-20(27)28)14-10-17(24(30)34-4)22(32-2)19(26)12-14/h7,9-12H,5-6,8H2,1-4H3,(H,27,28)