(2S,3R)-2-azido-3-phenylmethoxy-icosan-1-ol

Systemtic Name: (2S,3R)-2-azido-3-phenylmethoxy-icosan-1-ol Openeye Name: (2S,3R)-2-azido-3-benzyloxy-icosan-1-ol CAS Name: (2S,3R)-2-azido-3-phenylmethoxy-1-eicosanol IUPAC Name: (2S,3R)-2-azido-3-phenylmethoxyicosan-1-ol Traditional Name: (2S,3R)-2-azido-3-benzoxy-eicosan-1-ol Formula: C27H47N3O2 MolecularWeight: 445.68098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C(CO)N=[N+]=[N-])OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCC[C@H]([C@H](CO)N=[N+]=[N-])OCC1=CC=CC=C1

InChI

InChI=1S/C27H47N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-27(26(23-31)29-30-28)32-24-25-20-17-16-18-21-25/h16-18,20-21,26-27,31H,2-15,19,22-24H2,1H3/t26-,27+/m0/s1