(2S,3R,4E,8E)-1,3-bis(phenylmethoxy)-7-phenylsulfanyl-octadeca-4,8-dien-2-amine

Systemtic Name: (2S,3R,4E,8E)-1,3-bis(phenylmethoxy)-7-phenylsulfanyl-octadeca-4,8-dien-2-amine Openeye Name: (2S,3R,4E,8E)-1,3-dibenzyloxy-7-phenylsulfanyl-octadeca-4,8-dien-2-amine CAS Name: (2S,3R,4E,8E)-1,3-bis(phenylmethoxy)-7-(phenylthio)-2-octadeca-4,8-dienamine IUPAC Name: (2S,3R,4E,8E)-1,3-bis(phenylmethoxy)-7-phenylsulfanyloctadeca-4,8-dien-2-amine Traditional Name: [(1S,2R,3E,7E)-2-benzoxy-1-(benzoxymethyl)-6-(phenylthio)heptadeca-3,7-dienyl]amine Formula: C38H51NO2S MolecularWeight: 585.88204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CC(CC=CC(C(COCC1=CC=CC=C1)N)OCC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC/C=C/C(C/C=C/[C@H]([C@H](COCC1=CC=CC=C1)N)OCC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C38H51NO2S/c1-2-3-4-5-6-7-8-9-17-25-36(42-35-26-18-12-19-27-35)28-20-29-38(41-31-34-23-15-11-16-24-34)37(39)32-40-30-33-21-13-10-14-22-33/h10-27,29,36-38H,2-9,28,30-32,39H2,1H3/b25-17+,29-20+/t36?,37-,38+/m0/s1