ethyl 4-[[(3S)-1-ethylsulfonylpiperidin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[(3S)-1-ethylsulfonylpiperidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(3S)-1-ethylsulfonylpiperidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-ethylsulfonyl-3-piperidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-1-ethylsulfonylpiperidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-esylnipecotoyl]amino]benzoic acid ethyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)CC

InChI

InChI=1S/C17H24N2O5S/c1-3-24-17(21)13-7-9-15(10-8-13)18-16(20)14-6-5-11-19(12-14)25(22,23)4-2/h7-10,14H,3-6,11-12H2,1-2H3,(H,18,20)/t14-/m0/s1