(E,2S,3R)-2-azanyl-1-phenylmethoxy-octadec-4-en-3-ol

Systemtic Name: (E,2S,3R)-2-azanyl-1-phenylmethoxy-octadec-4-en-3-ol Openeye Name: (E,2S,3R)-2-amino-1-benzyloxy-octadec-4-en-3-ol CAS Name: (E,2S,3R)-2-amino-1-phenylmethoxy-4-octadecen-3-ol IUPAC Name: (E,2S,3R)-2-amino-1-phenylmethoxyoctadec-4-en-3-ol Traditional Name: (E,2S,3R)-2-amino-1-benzoxy-octadec-4-en-3-ol Formula: C25H43NO2 MolecularWeight: 389.61442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-25(27)24(26)22-28-21-23-18-15-14-16-19-23/h14-20,24-25,27H,2-13,21-22,26H2,1H3/b20-17+/t24-,25+/m0/s1