(2-bromanyl-4-phenyl-phenyl) 3-(4-butoxy-3-ethoxy-phenyl)propanoate

Systemtic Name: (2-bromanyl-4-phenyl-phenyl) 3-(4-butoxy-3-ethoxy-phenyl)propanoate Openeye Name: (2-bromo-4-phenyl-phenyl) 3-(4-butoxy-3-ethoxy-phenyl)propanoate CAS Name: 3-(4-butoxy-3-ethoxyphenyl)propanoic acid (2-bromo-4-phenylphenyl) ester IUPAC Name: (2-bromo-4-phenylphenyl) 3-(4-butoxy-3-ethoxyphenyl)propanoate Traditional Name: 3-(4-butoxy-3-ethoxy-phenyl)propionic acid (2-bromo-4-phenyl-phenyl) ester Formula: C27H29BrO4 MolecularWeight: 497.42076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)C3=CC=CC=C3)Br)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)C3=CC=CC=C3)Br)OCC

InChI

InChI=1S/C27H29BrO4/c1-3-5-17-31-25-14-11-20(18-26(25)30-4-2)12-16-27(29)32-24-15-13-22(19-23(24)28)21-9-7-6-8-10-21/h6-11,13-15,18-19H,3-5,12,16-17H2,1-2H3