methyl 2-[[(3R)-1-ethylsulfonylpiperidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(3R)-1-ethylsulfonylpiperidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(3R)-1-ethylsulfonylpiperidine-3-carbonyl]amino]benzoate CAS Name: 2-[[[(3R)-1-ethylsulfonyl-3-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3R)-1-ethylsulfonylpiperidine-3-carbonyl]amino]benzoate Traditional Name: 2-[[(3R)-1-esylnipecotoyl]amino]benzoic acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CCS(=O)(=O)N1CCC[C@H](C1)C(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C16H22N2O5S/c1-3-24(21,22)18-10-6-7-12(11-18)15(19)17-14-9-5-4-8-13(14)16(20)23-2/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,17,19)/t12-/m1/s1