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

Systemtic Name: tert-butyl 4-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-bromo-2-methoxy-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(5-bromo-2-methoxyphenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-bromo-2-methoxyphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C16H23BrN2O5S MolecularWeight: 435.33322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23BrN2O5S/c1-16(2,3)24-15(20)18-7-9-19(10-8-18)25(21,22)14-11-12(17)5-6-13(14)23-4/h5-6,11H,7-10H2,1-4H3