tert-butyl N-[2-methoxy-5-[(2-nitrophenyl)methyl-[1-(oxidanylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-methoxy-5-[(2-nitrophenyl)methyl-[1-(oxidanylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[5-[[2-(hydroxyamino)-1-methyl-2-oxo-ethyl]-[(2-nitrophenyl)methyl]sulfamoyl]-2-methoxy-phenyl]carbamate CAS Name: N-[5-[[1-(hydroxyamino)-1-oxopropan-2-yl]-[(2-nitrophenyl)methyl]sulfamoyl]-2-methoxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[[1-(hydroxyamino)-1-oxopropan-2-yl]-[(2-nitrophenyl)methyl]sulfamoyl]-2-methoxyphenyl]carbamate Traditional Name: N-[5-[[2-(hydroxyamino)-2-keto-1-methyl-ethyl]-(2-nitrobenzyl)sulfamoyl]-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C22H28N4O9S MolecularWeight: 524.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NO)N(CC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)NO)N(CC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H28N4O9S/c1-14(20(27)24-29)25(13-15-8-6-7-9-18(15)26(30)31)36(32,33)16-10-11-19(34-5)17(12-16)23-21(28)35-22(2,3)4/h6-12,14,29H,13H2,1-5H3,(H,23,28)(H,24,27)