3-[4-[[3-(2,6-dimethylphenyl)-4-phenylmethoxy-phenyl]methoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[[3-(2,6-dimethylphenyl)-4-phenylmethoxy-phenyl]methoxy]phenyl]propanoic acid Openeye Name: 3-[4-[[4-benzyloxy-3-(2,6-dimethylphenyl)phenyl]methoxy]phenyl]propanoic acid CAS Name: 3-[4-[[3-(2,6-dimethylphenyl)-4-phenylmethoxyphenyl]methoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[[3-(2,6-dimethylphenyl)-4-phenylmethoxyphenyl]methoxy]phenyl]propanoic acid Traditional Name: 3-[4-[4-benzoxy-3-(2,6-dimethylphenyl)benzyl]oxyphenyl]propionic acid Formula: C31H30O4 MolecularWeight: 466.5675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=C(C=CC(=C2)COC3=CC=C(C=C3)CCC(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=C(C=CC(=C2)COC3=CC=C(C=C3)CCC(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H30O4/c1-22-7-6-8-23(2)31(22)28-19-26(13-17-29(28)35-20-25-9-4-3-5-10-25)21-34-27-15-11-24(12-16-27)14-18-30(32)33/h3-13,15-17,19H,14,18,20-21H2,1-2H3,(H,32,33)