3-[3-bromanyl-4-[(Z)-5-(2,4-dimethoxyphenyl)-3-methyl-pent-2-en-4-ynoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[3-bromanyl-4-[(Z)-5-(2,4-dimethoxyphenyl)-3-methyl-pent-2-en-4-ynoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[3-bromo-4-[(Z)-5-(2,4-dimethoxyphenyl)-3-methyl-pent-2-en-4-ynoxy]phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[3-bromo-4-[(Z)-5-(2,4-dimethoxyphenyl)-3-methylpent-2-en-4-ynoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[3-bromo-4-[(Z)-5-(2,4-dimethoxyphenyl)-3-methylpent-2-en-4-ynoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[3-bromo-4-[(Z)-5-(2,4-dimethoxyphenyl)-3-methyl-pent-2-en-4-ynoxy]phenyl]-2-ethoxy-propionic acid Formula: C25H27BrO6 MolecularWeight: 503.38228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC(=C(C=C1)OCC=C(C)C#CC2=C(C=C(C=C2)OC)OC)Br)C(=O)O

Isomeric SMILES

CCOC(CC1=CC(=C(C=C1)OC/C=C(/C)\C#CC2=C(C=C(C=C2)OC)OC)Br)C(=O)O

InChI

InChI=1S/C25H27BrO6/c1-5-31-24(25(27)28)15-18-7-11-22(21(26)14-18)32-13-12-17(2)6-8-19-9-10-20(29-3)16-23(19)30-4/h7,9-12,14,16,24H,5,13,15H2,1-4H3,(H,27,28)/b17-12-