O1-tert-butyl O4-[(2S)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[(2S)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl] piperidine-1,4-dicarboxylate Openeye Name: O4-[(1S)-2-(3-acetylanilino)-1-methyl-2-oxo-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O4-[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl] ester O1-tert-butyl ester IUPAC Name: 4-O-[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl] 1-O-tert-butyl piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O4-[(1S)-2-(3-acetylanilino)-2-keto-1-methyl-ethyl] ester O1-tert-butyl ester Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)OC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)C(=O)C)OC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H30N2O6/c1-14(25)17-7-6-8-18(13-17)23-19(26)15(2)29-20(27)16-9-11-24(12-10-16)21(28)30-22(3,4)5/h6-8,13,15-16H,9-12H2,1-5H3,(H,23,26)/t15-/m0/s1