4-chloranyl-2-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-phenyl]sulfonylcarbamoylamino]benzoic acid

Systemtic Name: 4-chloranyl-2-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-phenyl]sulfonylcarbamoylamino]benzoic acid Openeye Name: 2-[(3-tert-butoxycarbonyl-4-hydroxy-phenyl)sulfonylcarbamoylamino]-4-chloro-benzoic acid CAS Name: 4-chloro-2-[[[[4-hydroxy-3-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]sulfonylamino]-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-2-[[4-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfonylcarbamoylamino]benzoic acid Traditional Name: 2-[(3-tert-butoxycarbonyl-4-hydroxy-phenyl)sulfonylcarbamoylamino]-4-chloro-benzoic acid Formula: C19H19ClN2O8S MolecularWeight: 470.88076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O)O

InChI

InChI=1S/C19H19ClN2O8S/c1-19(2,3)30-17(26)13-9-11(5-7-15(13)23)31(28,29)22-18(27)21-14-8-10(20)4-6-12(14)16(24)25/h4-9,23H,1-3H3,(H,24,25)(H2,21,22,27)