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

Systemtic Name: 5-[[3-[(3-carboxy-4-oxidanyl-phenyl)methyl]-5-methyl-2-phenylmethoxy-phenyl]methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[[2-benzyloxy-3-[(3-carboxy-4-hydroxy-phenyl)methyl]-5-methyl-phenyl]methyl]-2-hydroxy-benzoic acid CAS Name: 5-[[3-[(3-carboxy-4-hydroxyphenyl)methyl]-5-methyl-2-phenylmethoxyphenyl]methyl]-2-hydroxybenzoic acid IUPAC Name: 5-[[3-[(3-carboxy-4-hydroxyphenyl)methyl]-5-methyl-2-phenylmethoxyphenyl]methyl]-2-hydroxybenzoic acid Traditional Name: 5-[2-benzoxy-3-(3-carboxy-4-hydroxy-benzyl)-5-methyl-benzyl]-2-hydroxy-benzoic acid Formula: C30H26O7 MolecularWeight: 498.52324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CC2=CC(=C(C=C2)O)C(=O)O)OCC3=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)OCC3=CC=CC=C3)CC4=CC(=C(C=C4)O)C(=O)O

InChI

InChI=1S/C30H26O7/c1-18-11-22(13-20-7-9-26(31)24(15-20)29(33)34)28(37-17-19-5-3-2-4-6-19)23(12-18)14-21-8-10-27(32)25(16-21)30(35)36/h2-12,15-16,31-32H,13-14,17H2,1H3,(H,33,34)(H,35,36)