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4-[(2-phenethyl-6-phenyl-phenoxy)methyl]benzoic acid

4-[(2-phenethyl-6-phenyl-phenoxy)methyl]benzoic acid

Systemtic Name:4-[(2-phenethyl-6-phenyl-phenoxy)methyl]benzoic acid
Openeye Name:4-[(2-phenethyl-6-phenyl-phenoxy)methyl]benzoic acid
CAS Name:4-[(2-phenethyl-6-phenylphenoxy)methyl]benzoic acid
IUPAC Name:4-[(2-phenethyl-6-phenylphenoxy)methyl]benzoic acid
Traditional Name:4-[(2-phenethyl-6-phenyl-phenoxy)methyl]benzoic acid
Formula: C28H24O3
MolecularWeight: 408.48836
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=CC(=C2OCC3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4


Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=CC(=C2OCC3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4


InChI

InChI=1S/C28H24O3/c29-28(30)25-18-15-22(16-19-25)20-31-27-24(17-14-21-8-3-1-4-9-21)12-7-13-26(27)23-10-5-2-6-11-23/h1-13,15-16,18-19H,14,17,20H2,(H,29,30)


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