methyl (2S,3S,6R)-6-[(2E)-dodeca-2,11-dienyl]-2-methyl-3-phenylmethoxy-piperidine-1-carboxylate

Systemtic Name: methyl (2S,3S,6R)-6-[(2E)-dodeca-2,11-dienyl]-2-methyl-3-phenylmethoxy-piperidine-1-carboxylate Openeye Name: methyl (2S,3S,6R)-3-benzyloxy-6-[(2E)-dodeca-2,11-dienyl]-2-methyl-piperidine-1-carboxylate CAS Name: (2S,3S,6R)-6-[(2E)-dodeca-2,11-dienyl]-2-methyl-3-phenylmethoxy-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,6R)-6-[(2E)-dodeca-2,11-dienyl]-2-methyl-3-phenylmethoxypiperidine-1-carboxylate Traditional Name: (2S,3S,6R)-3-benzoxy-6-[(2E)-dodeca-2,11-dienyl]-2-methyl-piperidine-1-carboxylic acid methyl ester Formula: C27H41NO3 MolecularWeight: 427.61934

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC(N1C(=O)OC)CC=CCCCCCCCC=C)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1[C@H](CC[C@@H](N1C(=O)OC)C/C=C/CCCCCCCC=C)OCC2=CC=CC=C2

InChI

InChI=1S/C27H41NO3/c1-4-5-6-7-8-9-10-11-12-16-19-25-20-21-26(23(2)28(25)27(29)30-3)31-22-24-17-14-13-15-18-24/h4,12-18,23,25-26H,1,5-11,19-22H2,2-3H3/b16-12+/t23-,25-,26-/m0/s1