[(4E,8E)-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]azanium

Systemtic Name: [(4E,8E)-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]azanium Openeye Name: [(3E,7E)-2-hydroxy-1-(hydroxymethyl)heptadeca-3,7-dienyl]ammonium CAS Name: [(4E,8E)-1,3-dihydroxyoctadeca-4,8-dien-2-yl]ammonium IUPAC Name: [(4E,8E)-1,3-dihydroxyoctadeca-4,8-dien-2-yl]azanium Traditional Name: [(3E,7E)-2-hydroxy-1-methylol-heptadeca-3,7-dienyl]ammonium Formula: C18H36NO2+ MolecularWeight: 298.48394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CCCC=CC(C(CO)[NH3+])O

Isomeric SMILES

CCCCCCCCC/C=C/CC/C=C/C(C(CO)[NH3+])O

InChI

InChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h10-11,14-15,17-18,20-21H,2-9,12-13,16,19H2,1H3/p+1/b11-10+,15-14+