methyl (2R,4R)-4-acetamido-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxylate

Systemtic Name: methyl (2R,4R)-4-acetamido-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxylate Openeye Name: methyl (2R,4R)-4-acetamido-1-(p-tolylsulfonyl)piperidine-2-carboxylate CAS Name: (2R,4R)-4-acetamido-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4R)-4-acetamido-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2R,4R)-4-acetamido-1-tosyl-pipecolinic acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2C(=O)OC)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[C@H](C[C@@H]2C(=O)OC)NC(=O)C

InChI

InChI=1S/C16H22N2O5S/c1-11-4-6-14(7-5-11)24(21,22)18-9-8-13(17-12(2)19)10-15(18)16(20)23-3/h4-7,13,15H,8-10H2,1-3H3,(H,17,19)/t13-,15-/m1/s1