ethyl 2-[[(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[(3S)-1-(p-tolylsulfonyl)piperidine-3-carbonyl]amino]acetate CAS Name: 2-[[[(3S)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(3S)-1-(4-methylphenyl)sulfonylpiperidine-3-carbonyl]amino]acetate Traditional Name: 2-[[(3S)-1-tosylnipecotoyl]amino]acetic acid ethyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H24N2O5S/c1-3-24-16(20)11-18-17(21)14-5-4-10-19(12-14)25(22,23)15-8-6-13(2)7-9-15/h6-9,14H,3-5,10-12H2,1-2H3,(H,18,21)/t14-/m0/s1