methyl 2-[(2S,4R)-2-methyl-1-(4-methylphenyl)sulfonyl-piperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[(2S,4R)-2-methyl-1-(4-methylphenyl)sulfonyl-piperidin-4-yl]ethanoate Openeye Name: methyl 2-[(2S,4R)-2-methyl-1-(p-tolylsulfonyl)-4-piperidyl]acetate CAS Name: 2-[(2S,4R)-2-methyl-1-(4-methylphenyl)sulfonyl-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S,4R)-2-methyl-1-(4-methylphenyl)sulfonylpiperidin-4-yl]acetate Traditional Name: 2-[(2S,4R)-2-methyl-1-tosyl-4-piperidyl]acetic acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN1S(=O)(=O)C2=CC=C(C=C2)C)CC(=O)OC

Isomeric SMILES

C[C@H]1C[C@@H](CCN1S(=O)(=O)C2=CC=C(C=C2)C)CC(=O)OC

InChI

InChI=1S/C16H23NO4S/c1-12-4-6-15(7-5-12)22(19,20)17-9-8-14(10-13(17)2)11-16(18)21-3/h4-7,13-14H,8-11H2,1-3H3/t13-,14+/m0/s1