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

Systemtic Name: ethyl 1-(2-bromanyl-4,5-dimethyl-phenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-bromo-4,5-dimethyl-phenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2-bromo-4,5-dimethylphenyl)sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-bromo-4,5-dimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-bromo-4,5-dimethyl-phenyl)sulfonylisonipecotic acid ethyl ester Formula: C16H22BrNO4S MolecularWeight: 404.31918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrNO4S/c1-4-22-16(19)13-5-7-18(8-6-13)23(20,21)15-10-12(3)11(2)9-14(15)17/h9-10,13H,4-8H2,1-3H3