[(2R)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl] 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [(2R)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl] 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [(1R)-1-methyl-2-morpholino-2-oxo-ethyl] 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid [(2R)-1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-morpholin-4-yl-1-oxopropan-2-yl] 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-phenetylsulfonylisonipecotic acid [(1R)-2-keto-1-methyl-2-morpholino-ethyl] ester Formula: C21H30N2O7S MolecularWeight: 454.5371

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC(C)C(=O)N3CCOCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)O[C@H](C)C(=O)N3CCOCC3

InChI

InChI=1S/C21H30N2O7S/c1-3-29-18-4-6-19(7-5-18)31(26,27)23-10-8-17(9-11-23)21(25)30-16(2)20(24)22-12-14-28-15-13-22/h4-7,16-17H,3,8-15H2,1-2H3/t16-/m1/s1