(2S)-N-[(2S,3R)-1-oxidanyl-3-phenylmethoxy-octadecan-2-yl]-2-phenylmethoxy-tetradecanamide

Systemtic Name: (2S)-N-[(2S,3R)-1-oxidanyl-3-phenylmethoxy-octadecan-2-yl]-2-phenylmethoxy-tetradecanamide Openeye Name: (2S)-2-benzyloxy-N-[(1S,2R)-2-benzyloxy-1-(hydroxymethyl)heptadecyl]tetradecanamide CAS Name: (2S)-N-[(2S,3R)-1-hydroxy-3-phenylmethoxyoctadecan-2-yl]-2-phenylmethoxytetradecanamide IUPAC Name: (2S)-N-[(2S,3R)-1-hydroxy-3-phenylmethoxyoctadecan-2-yl]-2-phenylmethoxytetradecanamide Traditional Name: (2S)-2-benzoxy-N-[(1S,2R)-2-benzoxy-1-methylol-heptadecyl]myristamide Formula: C46H77NO4 MolecularWeight: 708.10788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(CO)NC(=O)C(CCCCCCCCCCCC)OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC[C@H]([C@H](CO)NC(=O)[C@H](CCCCCCCCCCCC)OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C46H77NO4/c1-3-5-7-9-11-13-15-16-17-19-20-22-30-36-44(50-39-41-32-26-24-27-33-41)43(38-48)47-46(49)45(51-40-42-34-28-25-29-35-42)37-31-23-21-18-14-12-10-8-6-4-2/h24-29,32-35,43-45,48H,3-23,30-31,36-40H2,1-2H3,(H,47,49)/t43-,44+,45-/m0/s1