3-(hexadecanoylamino)propyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-bis[(E)-2-phenylethenyl]azanium

Systemtic Name: 3-(hexadecanoylamino)propyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-bis[(E)-2-phenylethenyl]azanium Openeye Name: 3-(hexadecanoylamino)propyl-[(2-oxopyrrolidin-1-yl)methyl]-bis[(E)-styryl]ammonium CAS Name: 3-(1-oxohexadecylamino)propyl-[(2-oxo-1-pyrrolidinyl)methyl]-bis[(E)-2-phenylethenyl]ammonium IUPAC Name: 3-(hexadecanoylamino)propyl-[(2-oxopyrrolidin-1-yl)methyl]-bis[(E)-2-phenylethenyl]azanium Traditional Name: (2-ketopyrrolidino)methyl-(3-palmitamidopropyl)-bis[(E)-styryl]ammonium Formula: C40H60N3O2+ MolecularWeight: 614.9233

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NCCC[N+](CN1CCCC1=O)(C=CC2=CC=CC=C2)C=CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NCCC[N+](/C=C/C1=CC=CC=C1)(/C=C/C2=CC=CC=C2)CN3C(=O)CCC3

InChI

InChI=1S/C40H59N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-27-39(44)41-31-22-33-43(36-42-32-21-28-40(42)45,34-29-37-23-16-14-17-24-37)35-30-38-25-18-15-19-26-38/h14-19,23-26,29-30,34-35H,2-13,20-22,27-28,31-33,36H2,1H3/p+1/b34-29+,35-30+