4-oxidanylidene-4-[[4-[4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]sulfonylphenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[4-[4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]sulfonylphenyl]amino]butanoic acid Openeye Name: 4-[4-[4-[(4-hydroxy-4-oxo-butanoyl)amino]phenyl]sulfonylanilino]-4-oxo-butanoic acid CAS Name: 4-[4-[4-[(4-hydroxy-1,4-dioxobutyl)amino]phenyl]sulfonylanilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[4-[(4-hydroxy-4-oxobutanoyl)amino]phenyl]sulfonylanilino]-4-oxobutanoic acid Traditional Name: 4-[4-[4-[(4-hydroxy-4-keto-butanoyl)amino]phenyl]sulfonylanilino]-4-keto-butyric acid Formula: C20H20N2O8S MolecularWeight: 448.4464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C20H20N2O8S/c23-17(9-11-19(25)26)21-13-1-5-15(6-2-13)31(29,30)16-7-3-14(4-8-16)22-18(24)10-12-20(27)28/h1-8H,9-12H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)