tert-butyl N-[2-(2-chloranyl-4-oxidanyl-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)ethyl]carbamate

Systemtic Name: tert-butyl N-[2-(2-chloranyl-4-oxidanyl-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)ethyl]carbamate Openeye Name: tert-butyl N-[2-(2-chloro-4-hydroxy-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)ethyl]carbamate CAS Name: N-[2-(2-chloro-4-hydroxy-3-sulfamoyl-1-cyclohexa-1,3-dienyl)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(2-chloro-4-hydroxy-3-sulfamoylcyclohexa-1,3-dien-1-yl)ethyl]carbamate Traditional Name: N-[2-(2-chloro-4-hydroxy-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)ethyl]carbamic acid tert-butyl ester Formula: C13H21ClN2O5S MolecularWeight: 352.83424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=C(C(=C(CC1)O)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=C(C(=C(CC1)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C13H21ClN2O5S/c1-13(2,3)21-12(18)16-7-6-8-4-5-9(17)11(10(8)14)22(15,19)20/h17H,4-7H2,1-3H3,(H,16,18)(H2,15,19,20)