4-[2-[(4-oxidanyl-4-oxidanylidene-butyl)-(phenylsulfonyl)amino]ethyl-(phenylsulfonyl)amino]butanoic acid

Systemtic Name: 4-[2-[(4-oxidanyl-4-oxidanylidene-butyl)-(phenylsulfonyl)amino]ethyl-(phenylsulfonyl)amino]butanoic acid Openeye Name: 4-[benzenesulfonyl-[2-[benzenesulfonyl-(4-hydroxy-4-oxo-butyl)amino]ethyl]amino]butanoic acid CAS Name: 4-[benzenesulfonyl-[2-[benzenesulfonyl-(4-hydroxy-4-oxobutyl)amino]ethyl]amino]butanoic acid IUPAC Name: 4-[benzenesulfonyl-[2-[benzenesulfonyl-(4-hydroxy-4-oxobutyl)amino]ethyl]amino]butanoic acid Traditional Name: 4-[besyl-[2-[besyl-(4-hydroxy-4-keto-butyl)amino]ethyl]amino]butyric acid Formula: C22H28N2O8S2 MolecularWeight: 512.59632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CCCC(=O)O)CCN(CCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CCCC(=O)O)CCN(CCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O8S2/c25-21(26)13-7-15-23(33(29,30)19-9-3-1-4-10-19)17-18-24(16-8-14-22(27)28)34(31,32)20-11-5-2-6-12-20/h1-6,9-12H,7-8,13-18H2,(H,25,26)(H,27,28)