(2S,3R)-2-azanyl-3-phenylmethoxy-octadecan-1-ol

Systemtic Name: (2S,3R)-2-azanyl-3-phenylmethoxy-octadecan-1-ol Openeye Name: (2S,3R)-2-amino-3-benzyloxy-octadecan-1-ol CAS Name: (2S,3R)-2-amino-3-phenylmethoxy-1-octadecanol IUPAC Name: (2S,3R)-2-amino-3-phenylmethoxyoctadecan-1-ol Traditional Name: (2S,3R)-2-amino-3-benzoxy-octadecan-1-ol Formula: C25H45NO2 MolecularWeight: 391.6303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(CO)N)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCC[C@H]([C@H](CO)N)OCC1=CC=CC=C1

InChI

InChI=1S/C25H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-25(24(26)21-27)28-22-23-18-15-14-16-19-23/h14-16,18-19,24-25,27H,2-13,17,20-22,26H2,1H3/t24-,25+/m0/s1