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

Systemtic Name: ethyl 2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]acetate CAS Name: 2-[[[(3S)-1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]acetate Traditional Name: 2-[[(3S)-1-(4-chlorophenyl)sulfonylnipecotoyl]amino]acetic acid ethyl ester Formula: C16H21ClN2O5S MolecularWeight: 388.86634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21ClN2O5S/c1-2-24-15(20)10-18-16(21)12-4-3-9-19(11-12)25(22,23)14-7-5-13(17)6-8-14/h5-8,12H,2-4,9-11H2,1H3,(H,18,21)/t12-/m0/s1