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

Systemtic Name: ethyl 1-(4-bromanyl-2,5-dimethoxy-phenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-bromo-2,5-dimethoxy-phenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-bromo-2,5-dimethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-bromo-2,5-dimethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-bromo-2,5-dimethoxy-phenyl)sulfonylisonipecotic acid ethyl ester Formula: C16H22BrNO6S MolecularWeight: 436.31798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)OC)Br)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)OC)Br)OC

InChI

InChI=1S/C16H22BrNO6S/c1-4-24-16(19)11-5-7-18(8-6-11)25(20,21)15-10-13(22-2)12(17)9-14(15)23-3/h9-11H,4-8H2,1-3H3