[(2S)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [(2S)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [(1S)-2-[(2S,6S)-2,6-dimethyl-1-piperidyl]-1-methyl-2-oxo-ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [(2S)-1-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [(1S)-2-[(2S,6S)-2,6-dimethylpiperidino]-2-keto-1-methyl-ethyl] ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C(C)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C)C)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)[C@H](C)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C)C)C

InChI

InChI=1S/C21H27N3O3/c1-12-7-6-8-13(2)24(12)20(25)16(5)27-21(26)17-9-10-18-19(11-17)23-15(4)14(3)22-18/h9-13,16H,6-8H2,1-5H3/t12-,13-,16-/m0/s1