tert-butyl 4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-bromo-4,5-dimethoxyphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C17H25BrN2O6S MolecularWeight: 465.3592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)OC)OC)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)OC)OC)Br

InChI

InChI=1S/C17H25BrN2O6S/c1-17(2,3)26-16(21)19-6-8-20(9-7-19)27(22,23)15-11-14(25-5)13(24-4)10-12(15)18/h10-11H,6-9H2,1-5H3