methyl (2S,3S,6S)-6-dodecyl-3-(phenylcarbonyloxy)piperidine-2-carboxylate

Systemtic Name: methyl (2S,3S,6S)-6-dodecyl-3-(phenylcarbonyloxy)piperidine-2-carboxylate Openeye Name: methyl (2S,3S,6S)-3-benzoyloxy-6-dodecyl-piperidine-2-carboxylate CAS Name: (2S,3S,6S)-3-benzoyloxy-6-dodecyl-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,6S)-3-benzoyloxy-6-dodecylpiperidine-2-carboxylate Traditional Name: (2S,3S,6S)-3-benzoyloxy-6-lauryl-pipecolinic acid methyl ester Formula: C26H41NO4 MolecularWeight: 431.60804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCC(C(N1)C(=O)OC)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCC[C@H]1CC[C@@H]([C@H](N1)C(=O)OC)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C26H41NO4/c1-3-4-5-6-7-8-9-10-11-15-18-22-19-20-23(24(27-22)26(29)30-2)31-25(28)21-16-13-12-14-17-21/h12-14,16-17,22-24,27H,3-11,15,18-20H2,1-2H3/t22-,23-,24-/m0/s1