(E)-2-azanyloctadec-4-ene-1,3-diol; trimethyl(2-phosphonooxyethyl)azanium

Systemtic Name: (E)-2-azanyloctadec-4-ene-1,3-diol; trimethyl(2-phosphonooxyethyl)azanium Openeye Name: (E)-2-aminooctadec-4-ene-1,3-diol; trimethyl(2-phosphonooxyethyl)ammonium CAS Name: (E)-2-amino-4-octadecene-1,3-diol; trimethyl(2-phosphonooxyethyl)ammonium IUPAC Name: (E)-2-aminooctadec-4-ene-1,3-diol; trimethyl(2-phosphonooxyethyl)azanium Traditional Name: (E)-2-aminooctadec-4-ene-1,3-diol; trimethyl(2-phosphonooxyethyl)ammonium Formula: C23H52N2O6P+ MolecularWeight: 483.642541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)N)O.C[N+](C)(C)CCOP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(CO)N)O.C[N+](C)(C)CCOP(=O)(O)O

InChI

InChI=1S/C18H37NO2.C5H14NO4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20;1-6(2,3)4-5-10-11(7,8)9/h14-15,17-18,20-21H,2-13,16,19H2,1H3;4-5H2,1-3H3,(H-,7,8,9)/p+1/b15-14+;