ethyl 1-(4-methylsulfanylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-methylsulfanylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-methylsulfanylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-(methylthio)phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylsulfanylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-(methylthio)phenyl]sulfonylisonipecotic acid ethyl ester Formula: C15H21NO4S2 MolecularWeight: 343.46154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C15H21NO4S2/c1-3-20-15(17)12-8-10-16(11-9-12)22(18,19)14-6-4-13(21-2)5-7-14/h4-7,12H,3,8-11H2,1-2H3