(4-phenylphenyl) 3-(4-butoxy-3-ethoxy-phenyl)propanoate

Systemtic Name: (4-phenylphenyl) 3-(4-butoxy-3-ethoxy-phenyl)propanoate Openeye Name: (4-phenylphenyl) 3-(4-butoxy-3-ethoxy-phenyl)propanoate CAS Name: 3-(4-butoxy-3-ethoxyphenyl)propanoic acid (4-phenylphenyl) ester IUPAC Name: (4-phenylphenyl) 3-(4-butoxy-3-ethoxyphenyl)propanoate Traditional Name: 3-(4-butoxy-3-ethoxy-phenyl)propionic acid (4-phenylphenyl) ester Formula: C27H30O4 MolecularWeight: 418.5247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30O4/c1-3-5-19-30-25-17-11-21(20-26(25)29-4-2)12-18-27(28)31-24-15-13-23(14-16-24)22-9-7-6-8-10-22/h6-11,13-17,20H,3-5,12,18-19H2,1-2H3