3-[4-[(E)-3-(4-bromophenyl)-2-ethyl-but-2-enoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[(E)-3-(4-bromophenyl)-2-ethyl-but-2-enoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[4-[(E)-3-(4-bromophenyl)-2-ethyl-but-2-enoxy]phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[4-[(E)-3-(4-bromophenyl)-2-ethylbut-2-enoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[(E)-3-(4-bromophenyl)-2-ethylbut-2-enoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[4-[(E)-3-(4-bromophenyl)-2-ethyl-but-2-enoxy]phenyl]-2-ethoxy-propionic acid Formula: C23H27BrO4 MolecularWeight: 447.36208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C)C1=CC=C(C=C1)Br)COC2=CC=C(C=C2)CC(C(=O)O)OCC

Isomeric SMILES

CC/C(=C(/C)\C1=CC=C(C=C1)Br)/COC2=CC=C(C=C2)CC(C(=O)O)OCC

InChI

InChI=1S/C23H27BrO4/c1-4-18(16(3)19-8-10-20(24)11-9-19)15-28-21-12-6-17(7-13-21)14-22(23(25)26)27-5-2/h6-13,22H,4-5,14-15H2,1-3H3,(H,25,26)/b18-16+