3-[3-methyl-5-[1-[3-methyl-4-oxidanyl-5-(1-oxidanyl-1-oxidanylidene-pentan-3-yl)phenyl]-3-oxidanylidene-2-benzofuran-1-yl]-2-oxidanyl-phenyl]pentanoic acid

Systemtic Name: 3-[3-methyl-5-[1-[3-methyl-4-oxidanyl-5-(1-oxidanyl-1-oxidanylidene-pentan-3-yl)phenyl]-3-oxidanylidene-2-benzofuran-1-yl]-2-oxidanyl-phenyl]pentanoic acid Openeye Name: 3-[5-[1-[3-(1-ethyl-3-hydroxy-3-oxo-propyl)-4-hydroxy-5-methyl-phenyl]-3-oxo-isobenzofuran-1-yl]-2-hydroxy-3-methyl-phenyl]pentanoic acid CAS Name: 3-[2-hydroxy-5-[1-[4-hydroxy-3-(1-hydroxy-1-oxopentan-3-yl)-5-methylphenyl]-3-oxo-1-isobenzofuranyl]-3-methylphenyl]pentanoic acid IUPAC Name: 3-[2-hydroxy-5-[1-[4-hydroxy-3-(1-hydroxy-1-oxopentan-3-yl)-5-methylphenyl]-3-oxo-2-benzofuran-1-yl]-3-methylphenyl]pentanoic acid Traditional Name: 3-[5-[1-[3-(1-ethyl-3-hydroxy-3-keto-propyl)-4-hydroxy-5-methyl-phenyl]-3-keto-phthalan-1-yl]-2-hydroxy-3-methyl-phenyl]valeric acid Formula: C32H34O8 MolecularWeight: 546.60756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)C1=CC(=CC(=C1O)C)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)C(CC)CC(=O)O)O)C

Isomeric SMILES

CCC(CC(=O)O)C1=CC(=CC(=C1O)C)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)C(CC)CC(=O)O)O)C

InChI

InChI=1S/C32H34O8/c1-5-19(13-27(33)34)24-15-21(11-17(3)29(24)37)32(26-10-8-7-9-23(26)31(39)40-32)22-12-18(4)30(38)25(16-22)20(6-2)14-28(35)36/h7-12,15-16,19-20,37-38H,5-6,13-14H2,1-4H3,(H,33,34)(H,35,36)