2-[4-[2-[(3,5-dimethoxyphenyl)-oxidanyl-methyl]-5-phenyl-pentyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-[(3,5-dimethoxyphenyl)-oxidanyl-methyl]-5-phenyl-pentyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-[(3,5-dimethoxyphenyl)-hydroxy-methyl]-5-phenyl-pentyl]phenyl]acetic acid CAS Name: 2-[4-[2-[(3,5-dimethoxyphenyl)-hydroxymethyl]-5-phenylpentyl]phenyl]acetic acid IUPAC Name: 2-[4-[2-[(3,5-dimethoxyphenyl)-hydroxymethyl]-5-phenylpentyl]phenyl]acetic acid Traditional Name: 2-[4-[2-[(3,5-dimethoxyphenyl)-hydroxy-methyl]-5-phenyl-pentyl]phenyl]acetic acid Formula: C28H32O5 MolecularWeight: 448.55068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(C(CCCC2=CC=CC=C2)CC3=CC=C(C=C3)CC(=O)O)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(C(CCCC2=CC=CC=C2)CC3=CC=C(C=C3)CC(=O)O)O)OC

InChI

InChI=1S/C28H32O5/c1-32-25-17-24(18-26(19-25)33-2)28(31)23(10-6-9-20-7-4-3-5-8-20)15-21-11-13-22(14-12-21)16-27(29)30/h3-5,7-8,11-14,17-19,23,28,31H,6,9-10,15-16H2,1-2H3,(H,29,30)