2-[(2S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)-1-(phenylmethyl)piperidin-2-yl]ethanal

Systemtic Name: 2-[(2S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)-1-(phenylmethyl)piperidin-2-yl]ethanal Openeye Name: 2-[(2S,5S,6R)-1-benzyl-5-benzyloxy-6-(benzyloxymethyl)-2-piperidyl]acetaldehyde CAS Name: 2-[(2S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)-1-(phenylmethyl)-2-piperidinyl]acetaldehyde IUPAC Name: 2-[(2S,5S,6R)-1-benzyl-5-phenylmethoxy-6-(phenylmethoxymethyl)piperidin-2-yl]acetaldehyde Traditional Name: 2-[(2S,5S,6R)-5-benzoxy-6-(benzoxymethyl)-1-benzyl-2-piperidyl]acetaldehyde Formula: C29H33NO3 MolecularWeight: 443.57722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1CC=O)CC2=CC=CC=C2)COCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H]([C@H](N([C@@H]1CC=O)CC2=CC=CC=C2)COCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C29H33NO3/c31-19-18-27-16-17-29(33-22-26-14-8-3-9-15-26)28(23-32-21-25-12-6-2-7-13-25)30(27)20-24-10-4-1-5-11-24/h1-15,19,27-29H,16-18,20-23H2/t27-,28+,29-/m0/s1