tert-butyl 4-[[(6-chloranyl-3-nitro-2-oxidanyl-phenyl)sulfonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(6-chloranyl-3-nitro-2-oxidanyl-phenyl)sulfonylamino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(6-chloro-2-hydroxy-3-nitro-phenyl)sulfonylamino]methyl]piperidine-1-carboxylate CAS Name: 4-[[(6-chloro-2-hydroxy-3-nitrophenyl)sulfonylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(6-chloro-2-hydroxy-3-nitrophenyl)sulfonylamino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(6-chloro-2-hydroxy-3-nitro-phenyl)sulfonylamino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H24ClN3O7S MolecularWeight: 449.90636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CNS(=O)(=O)C2=C(C=CC(=C2O)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CNS(=O)(=O)C2=C(C=CC(=C2O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H24ClN3O7S/c1-17(2,3)28-16(23)20-8-6-11(7-9-20)10-19-29(26,27)15-12(18)4-5-13(14(15)22)21(24)25/h4-5,11,19,22H,6-10H2,1-3H3