tert-butyl 4-[(4-bromanyl-2-chloranyl-phenyl)sulfonyl-methyl-amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-bromanyl-2-chloranyl-phenyl)sulfonyl-methyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-bromo-2-chloro-phenyl)sulfonyl-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[(4-bromo-2-chlorophenyl)sulfonyl-methylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-bromo-2-chlorophenyl)sulfonyl-methylamino]piperidine-1-carboxylate Traditional Name: 4-[(4-bromo-2-chloro-phenyl)sulfonyl-methyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H24BrClN2O4S MolecularWeight: 467.80546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrClN2O4S/c1-17(2,3)25-16(22)21-9-7-13(8-10-21)20(4)26(23,24)15-6-5-12(18)11-14(15)19/h5-6,11,13H,7-10H2,1-4H3