tert-butyl 4-[[[(4-chloranyl-2-oxidanyl-phenyl)-sulfamoyl-carbamoyl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[[(4-chloranyl-2-oxidanyl-phenyl)-sulfamoyl-carbamoyl]amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[(4-chloro-2-hydroxy-phenyl)-sulfamoyl-carbamoyl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[(4-chloro-2-hydroxy-N-sulfamoylanilino)-oxomethyl]amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[[(4-chloro-2-hydroxyphenyl)-sulfamoylcarbamoyl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[(4-chloro-2-hydroxy-phenyl)-sulfamoyl-carbamoyl]amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27ClN4O6S MolecularWeight: 462.94818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CNC(=O)N(C2=C(C=C(C=C2)Cl)O)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CNC(=O)N(C2=C(C=C(C=C2)Cl)O)S(=O)(=O)N

InChI

InChI=1S/C18H27ClN4O6S/c1-18(2,3)29-17(26)22-8-6-12(7-9-22)11-21-16(25)23(30(20,27)28)14-5-4-13(19)10-15(14)24/h4-5,10,12,24H,6-9,11H2,1-3H3,(H,21,25)(H2,20,27,28)