2-oxidanylidene-2-[[4-[4-oxidanyl-3-(phenylsulfonyl)phenoxy]phenyl]amino]ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[[4-[4-oxidanyl-3-(phenylsulfonyl)phenoxy]phenyl]amino]ethanoic acid Openeye Name: 2-[4-[3-(benzenesulfonyl)-4-hydroxy-phenoxy]anilino]-2-oxo-acetic acid CAS Name: 2-[4-[3-(benzenesulfonyl)-4-hydroxyphenoxy]anilino]-2-oxoacetic acid IUPAC Name: 2-[4-[3-(benzenesulfonyl)-4-hydroxyphenoxy]anilino]-2-oxoacetic acid Traditional Name: 2-[4-(3-besyl-4-hydroxy-phenoxy)anilino]-2-keto-acetic acid Formula: C20H15NO7S MolecularWeight: 413.4006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)OC3=CC=C(C=C3)NC(=O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)OC3=CC=C(C=C3)NC(=O)C(=O)O)O

InChI

InChI=1S/C20H15NO7S/c22-17-11-10-15(12-18(17)29(26,27)16-4-2-1-3-5-16)28-14-8-6-13(7-9-14)21-19(23)20(24)25/h1-12,22H,(H,21,23)(H,24,25)