(2R,3S,6S)-6-dodecyl-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)piperidine

Systemtic Name: (2R,3S,6S)-6-dodecyl-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)piperidine Openeye Name: (2R,3S,6S)-3-benzyloxy-2-(benzyloxymethyl)-6-dodecyl-1-(p-tolylsulfonyl)piperidine CAS Name: (2R,3S,6S)-6-dodecyl-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)piperidine IUPAC Name: (2R,3S,6S)-6-dodecyl-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)piperidine Traditional Name: (2R,3S,6S)-3-benzoxy-2-(benzoxymethyl)-6-lauryl-1-tosyl-piperidine Formula: C39H55NO4S MolecularWeight: 633.9233

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCC(C(N1S(=O)(=O)C2=CC=C(C=C2)C)COCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCC[C@H]1CC[C@@H]([C@H](N1S(=O)(=O)C2=CC=C(C=C2)C)COCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C39H55NO4S/c1-3-4-5-6-7-8-9-10-11-18-23-36-26-29-39(44-31-35-21-16-13-17-22-35)38(32-43-30-34-19-14-12-15-20-34)40(36)45(41,42)37-27-24-33(2)25-28-37/h12-17,19-22,24-25,27-28,36,38-39H,3-11,18,23,26,29-32H2,1-2H3/t36-,38+,39-/m0/s1