bis(aminomethyl)-[bis[(E)-octadec-9-enoxy]phosphorylmethyl]-methyl-azanium iodide

Systemtic Name: bis(aminomethyl)-[bis[(E)-octadec-9-enoxy]phosphorylmethyl]-methyl-azanium iodide Openeye Name: bis(aminomethyl)-[bis[(E)-octadec-9-enoxy]phosphorylmethyl]-methyl-ammonium iodide CAS Name: bis(aminomethyl)-[bis[(E)-octadec-9-enoxy]phosphorylmethyl]-methylammonium iodide IUPAC Name: bis(aminomethyl)-[bis[(E)-octadec-9-enoxy]phosphorylmethyl]-methylazanium iodide Traditional Name: bis(aminomethyl)-[bis[(E)-octadec-9-enoxy]phosphorylmethyl]-methyl-ammonium iodide Formula: C40H83IN3O3P MolecularWeight: 811.983551

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOP(=O)(C[N+](C)(CN)CN)OCCCCCCCCC=CCCCCCCCC.[I-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOP(=O)(OCCCCCCCC/C=C/CCCCCCCC)C[N+](CN)(CN)C.[I-]

InChI

InChI=1S/C40H83N3O3P.HI/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-45-47(44,40-43(3,38-41)39-42)46-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;/h18-21H,4-17,22-42H2,1-3H3;1H/q+1;/p-1/b20-18+,21-19+;