3-[4-[1,3-bis(oxidanylidene)-2-(1,3-thiazol-2-yl)isoindol-5-yl]oxyphenoxy]benzoic acid

Systemtic Name: 3-[4-[1,3-bis(oxidanylidene)-2-(1,3-thiazol-2-yl)isoindol-5-yl]oxyphenoxy]benzoic acid Openeye Name: 3-[4-(1,3-dioxo-2-thiazol-2-yl-isoindolin-5-yl)oxyphenoxy]benzoic acid CAS Name: 3-[4-[[1,3-dioxo-2-(2-thiazolyl)-5-isoindolyl]oxy]phenoxy]benzoic acid IUPAC Name: 3-[4-[1,3-dioxo-2-(1,3-thiazol-2-yl)isoindol-5-yl]oxyphenoxy]benzoic acid Traditional Name: 3-[4-(1,3-diketo-2-thiazol-2-yl-isoindolin-5-yl)oxyphenoxy]benzoic acid Formula: C24H14N2O6S MolecularWeight: 458.44276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC=C(C=C2)OC3=CC4=C(C=C3)C(=O)N(C4=O)C5=NC=CS5)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC=C(C=C2)OC3=CC4=C(C=C3)C(=O)N(C4=O)C5=NC=CS5)C(=O)O

InChI

InChI=1S/C24H14N2O6S/c27-21-19-9-8-18(13-20(19)22(28)26(21)24-25-10-11-33-24)32-16-6-4-15(5-7-16)31-17-3-1-2-14(12-17)23(29)30/h1-13H,(H,29,30)