[(2R)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [(2R)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: [(1R)-1-methyl-2-morpholino-2-oxo-ethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid [(2R)-1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-morpholin-4-yl-1-oxopropan-2-yl] 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid [(1R)-2-keto-1-methyl-2-morpholino-ethyl] ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OC(C)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)O[C@H](C)C(=O)N3CCOCC3

InChI

InChI=1S/C21H28N2O5/c1-15-5-3-4-6-18(15)20(25)22-9-7-17(8-10-22)21(26)28-16(2)19(24)23-11-13-27-14-12-23/h3-6,16-17H,7-14H2,1-2H3/t16-/m1/s1