ethyl (2S,3S)-3-azido-2-oxidanyl-octadec-4-ynoate

Systemtic Name: ethyl (2S,3S)-3-azido-2-oxidanyl-octadec-4-ynoate Openeye Name: ethyl (2S,3S)-3-azido-2-hydroxy-octadec-4-ynoate CAS Name: (2S,3S)-3-azido-2-hydroxy-4-octadecynoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-3-azido-2-hydroxyoctadec-4-ynoate Traditional Name: (2S,3S)-3-azido-2-hydroxy-octadec-4-ynoic acid ethyl ester Formula: C20H35N3O3 MolecularWeight: 365.5102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC#CC(C(C(=O)OCC)O)N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCCCCCCC#C[C@@H]([C@@H](C(=O)OCC)O)N=[N+]=[N-]

InChI

InChI=1S/C20H35N3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(22-23-21)19(24)20(25)26-4-2/h18-19,24H,3-15H2,1-2H3/t18-,19-/m0/s1