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

Systemtic Name: ethyl 4-(4-bromanyl-2,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(4-bromo-2,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(4-bromo-2,5-dimethoxyphenyl)sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-2,5-dimethoxyphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(4-bromo-2,5-dimethoxy-phenyl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C15H21BrN2O6S MolecularWeight: 437.30604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21BrN2O6S/c1-4-24-15(19)17-5-7-18(8-6-17)25(20,21)14-10-12(22-2)11(16)9-13(14)23-3/h9-10H,4-8H2,1-3H3