tert-butyl 4-[(2-chloranyl-4-oxidanyl-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2-chloranyl-4-oxidanyl-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-chloro-4-hydroxy-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)methyl]piperidine-1-carboxylate CAS Name: 4-[(2-chloro-4-hydroxy-3-sulfamoyl-1-cyclohexa-1,3-dienyl)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-chloro-4-hydroxy-3-sulfamoylcyclohexa-1,3-dien-1-yl)methyl]piperidine-1-carboxylate Traditional Name: 4-[(2-chloro-4-hydroxy-3-sulfamoyl-cyclohexa-1,3-dien-1-yl)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H27ClN2O5S MolecularWeight: 406.92468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CC2=C(C(=C(CC2)O)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CC2=C(C(=C(CC2)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C17H27ClN2O5S/c1-17(2,3)25-16(22)20-8-6-11(7-9-20)10-12-4-5-13(21)15(14(12)18)26(19,23)24/h11,21H,4-10H2,1-3H3,(H2,19,23,24)