methyl 1-[2-(4-methylphenyl)sulfonylethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(4-methylphenyl)sulfonylethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(p-tolylsulfonyl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-methylphenyl)sulfonyl-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-methylphenyl)sulfonylacetyl]piperidine-4-carboxylate Traditional Name: 1-(2-tosylacetyl)isonipecotic acid methyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5S/c1-12-3-5-14(6-4-12)23(20,21)11-15(18)17-9-7-13(8-10-17)16(19)22-2/h3-6,13H,7-11H2,1-2H3