tert-butyl N-[2-(2-azanyl-5-chloranyl-3-oxidanyl-4-sulfamoyl-phenyl)ethyl]carbamate

Systemtic Name: tert-butyl N-[2-(2-azanyl-5-chloranyl-3-oxidanyl-4-sulfamoyl-phenyl)ethyl]carbamate Openeye Name: tert-butyl N-[2-(2-amino-5-chloro-3-hydroxy-4-sulfamoyl-phenyl)ethyl]carbamate CAS Name: N-[2-(2-amino-5-chloro-3-hydroxy-4-sulfamoylphenyl)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(2-amino-5-chloro-3-hydroxy-4-sulfamoylphenyl)ethyl]carbamate Traditional Name: N-[2-(2-amino-5-chloro-3-hydroxy-4-sulfamoyl-phenyl)ethyl]carbamic acid tert-butyl ester Formula: C13H20ClN3O5S MolecularWeight: 365.833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=CC(=C(C(=C1N)O)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=CC(=C(C(=C1N)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C13H20ClN3O5S/c1-13(2,3)22-12(19)17-5-4-7-6-8(14)11(23(16,20)21)10(18)9(7)15/h6,18H,4-5,15H2,1-3H3,(H,17,19)(H2,16,20,21)