4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylsulfonylamino]-3-oxidanyl-benzoic acid

Systemtic Name: 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylsulfonylamino]-3-oxidanyl-benzoic acid Openeye Name: 4-[2-(tert-butoxycarbonylamino)ethylsulfonylamino]-3-hydroxy-benzoic acid CAS Name: 3-hydroxy-4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylsulfonylamino]benzoic acid IUPAC Name: 3-hydroxy-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylsulfonylamino]benzoic acid Traditional Name: 4-[2-(tert-butoxycarbonylamino)ethylsulfonylamino]-3-hydroxy-benzoic acid Formula: C14H20N2O7S MolecularWeight: 360.3828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCS(=O)(=O)NC1=C(C=C(C=C1)C(=O)O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCS(=O)(=O)NC1=C(C=C(C=C1)C(=O)O)O

InChI

InChI=1S/C14H20N2O7S/c1-14(2,3)23-13(20)15-6-7-24(21,22)16-10-5-4-9(12(18)19)8-11(10)17/h4-5,8,16-17H,6-7H2,1-3H3,(H,15,20)(H,18,19)