methyl (E)-13-azido-12-oxidanyl-octadec-9-enoate

Systemtic Name: methyl (E)-13-azido-12-oxidanyl-octadec-9-enoate Openeye Name: methyl (E)-13-azido-12-hydroxy-octadec-9-enoate CAS Name: (E)-13-azido-12-hydroxy-9-octadecenoic acid methyl ester IUPAC Name: methyl (E)-13-azido-12-hydroxyoctadec-9-enoate Traditional Name: (E)-13-azido-12-hydroxy-octadec-9-enoic acid methyl ester Formula: C19H35N3O3 MolecularWeight: 353.4995

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CC=CCCCCCCCC(=O)OC)O)N=[N+]=[N-]

Isomeric SMILES

CCCCCC(C(C/C=C/CCCCCCCC(=O)OC)O)N=[N+]=[N-]

InChI

InChI=1S/C19H35N3O3/c1-3-4-11-14-17(21-22-20)18(23)15-12-9-7-5-6-8-10-13-16-19(24)25-2/h9,12,17-18,23H,3-8,10-11,13-16H2,1-2H3/b12-9+