O1-tert-butyl O4-[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[(1S)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-tert-butyl 4-O-[(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[(1S)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)OC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H](C)OC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H31NO5/c1-14-7-8-15(2)18(13-14)19(24)16(3)27-20(25)17-9-11-23(12-10-17)21(26)28-22(4,5)6/h7-8,13,16-17H,9-12H2,1-6H3/t16-/m0/s1