5-[[3-[(3-carboxy-4-oxidanyl-phenyl)methyl]-5-methyl-2-(2-phenoxypropoxy)phenyl]methyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[3-[(3-carboxy-4-oxidanyl-phenyl)methyl]-5-methyl-2-(2-phenoxypropoxy)phenyl]methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[[3-[(3-carboxy-4-hydroxy-phenyl)methyl]-5-methyl-2-(2-phenoxypropoxy)phenyl]methyl]-2-hydroxy-benzoic acid CAS Name: 5-[[3-[(3-carboxy-4-hydroxyphenyl)methyl]-5-methyl-2-(2-phenoxypropoxy)phenyl]methyl]-2-hydroxybenzoic acid IUPAC Name: 5-[[3-[(3-carboxy-4-hydroxyphenyl)methyl]-5-methyl-2-(2-phenoxypropoxy)phenyl]methyl]-2-hydroxybenzoic acid Traditional Name: 5-[3-(3-carboxy-4-hydroxy-benzyl)-5-methyl-2-(2-phenoxypropoxy)benzyl]-2-hydroxy-benzoic acid Formula: C32H30O8 MolecularWeight: 542.5758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CC2=CC(=C(C=C2)O)C(=O)O)OCC(C)OC3=CC=CC=C3)CC4=CC(=C(C=C4)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)CC2=CC(=C(C=C2)O)C(=O)O)OCC(C)OC3=CC=CC=C3)CC4=CC(=C(C=C4)O)C(=O)O

InChI

InChI=1S/C32H30O8/c1-19-12-23(14-21-8-10-28(33)26(16-21)31(35)36)30(39-18-20(2)40-25-6-4-3-5-7-25)24(13-19)15-22-9-11-29(34)27(17-22)32(37)38/h3-13,16-17,20,33-34H,14-15,18H2,1-2H3,(H,35,36)(H,37,38)