2-[4-(1-benzothiophen-3-ylcarbonyl)-3-(4-hydroxyphenyl)-5-oxidanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(1-benzothiophen-3-ylcarbonyl)-3-(4-hydroxyphenyl)-5-oxidanyl-phenoxy]ethanoic acid Openeye Name: 2-[4-(benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]acetic acid CAS Name: 2-[4-[1-benzothiophen-3-yl(oxo)methyl]-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]acetic acid IUPAC Name: 2-[4-(1-benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]acetic acid Traditional Name: 2-[4-(benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]acetic acid Formula: C23H16O6S MolecularWeight: 420.43454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C(=O)C3=C(C=C(C=C3C4=CC=C(C=C4)O)OCC(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C(=O)C3=C(C=C(C=C3C4=CC=C(C=C4)O)OCC(=O)O)O

InChI

InChI=1S/C23H16O6S/c24-14-7-5-13(6-8-14)17-9-15(29-11-21(26)27)10-19(25)22(17)23(28)18-12-30-20-4-2-1-3-16(18)20/h1-10,12,24-25H,11H2,(H,26,27)