ethyl 1-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1R)-1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]piperidine-4-carboxylate CAS Name: 1-[(2R)-1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2R)-1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl]piperidine-4-carboxylate Traditional Name: 1-[(1R)-2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl]isonipecotic acid ethyl ester Formula: C22H33N3O5S MolecularWeight: 451.57952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)[C@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H33N3O5S/c1-3-30-22(27)18-11-15-24(16-12-18)17(2)21(26)23-19-7-9-20(10-8-19)31(28,29)25-13-5-4-6-14-25/h7-10,17-18H,3-6,11-16H2,1-2H3,(H,23,26)/t17-/m1/s1