N-[(E,2S,3S)-3-oxidanyl-1-phenylmethoxy-octadec-4-en-2-yl]ethanamide

Systemtic Name: N-[(E,2S,3S)-3-oxidanyl-1-phenylmethoxy-octadec-4-en-2-yl]ethanamide Openeye Name: N-[(E,1S,2S)-1-(benzyloxymethyl)-2-hydroxy-heptadec-3-enyl]acetamide CAS Name: N-[(E,2S,3S)-3-hydroxy-1-phenylmethoxyoctadec-4-en-2-yl]acetamide IUPAC Name: N-[(E,2S,3S)-3-hydroxy-1-phenylmethoxyoctadec-4-en-2-yl]acetamide Traditional Name: N-[(E,1S,2S)-1-(benzoxymethyl)-2-hydroxy-heptadec-3-enyl]acetamide Formula: C27H45NO3 MolecularWeight: 431.6511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(COCC1=CC=CC=C1)NC(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@@H]([C@H](COCC1=CC=CC=C1)NC(=O)C)O

InChI

InChI=1S/C27H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-21-27(30)26(28-24(2)29)23-31-22-25-19-16-15-17-20-25/h15-21,26-27,30H,3-14,22-23H2,1-2H3,(H,28,29)/b21-18+/t26-,27-/m0/s1