methyl 2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]ethanoate Openeye Name: methyl 2-[1-(p-tolylsulfonyl)-4-piperidyl]acetate CAS Name: 2-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]acetate Traditional Name: 2-(1-tosyl-4-piperidyl)acetic acid methyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4S/c1-12-3-5-14(6-4-12)21(18,19)16-9-7-13(8-10-16)11-15(17)20-2/h3-6,13H,7-11H2,1-2H3