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

Systemtic Name: (2R,3S,6R)-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-prop-2-enyl-piperidine Openeye Name: (2R,3S,6R)-6-allyl-3-benzyloxy-2-(benzyloxymethyl)-1-(p-tolylsulfonyl)piperidine CAS Name: (2R,3S,6R)-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-prop-2-enylpiperidine IUPAC Name: (2R,3S,6R)-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-prop-2-enylpiperidine Traditional Name: (2R,3S,6R)-6-allyl-3-benzoxy-2-(benzoxymethyl)-1-tosyl-piperidine Formula: C30H35NO4S MolecularWeight: 505.6682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC(C2COCC3=CC=CC=C3)OCC4=CC=CC=C4)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H](CC[C@@H]([C@H]2COCC3=CC=CC=C3)OCC4=CC=CC=C4)CC=C

InChI

InChI=1S/C30H35NO4S/c1-3-10-27-17-20-30(35-22-26-13-8-5-9-14-26)29(23-34-21-25-11-6-4-7-12-25)31(27)36(32,33)28-18-15-24(2)16-19-28/h3-9,11-16,18-19,27,29-30H,1,10,17,20-23H2,2H3/t27-,29+,30-/m0/s1