2-(4-methoxyphenyl)ethyl 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 2-(4-methoxyphenyl)ethyl 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 2-(4-methoxyphenyl)ethyl 1-(p-tolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid 2-(4-methoxyphenyl)ethyl ester IUPAC Name: 2-(4-methoxyphenyl)ethyl 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-tosylisonipecotic acid 2-(4-methoxyphenyl)ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27NO5S/c1-17-3-9-21(10-4-17)29(25,26)23-14-11-19(12-15-23)22(24)28-16-13-18-5-7-20(27-2)8-6-18/h3-10,19H,11-16H2,1-2H3