dimethyl-[3-[3-octadecyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl]-(phenylmethyl)azanium

Systemtic Name: dimethyl-[3-[3-octadecyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-dimethyl-[3-(3-octadecyl-2,5-dioxo-pyrrolidin-1-yl)propyl]ammonium CAS Name: dimethyl-[3-(3-octadecyl-2,5-dioxo-1-pyrrolidinyl)propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-dimethyl-[3-(3-octadecyl-2,5-dioxopyrrolidin-1-yl)propyl]azanium Traditional Name: benzyl-[3-(2,5-diketo-3-stearyl-pyrrolidino)propyl]-dimethyl-ammonium Formula: C34H59N2O2+ MolecularWeight: 527.84446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1CC(=O)N(C1=O)CCC[N+](C)(C)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1CC(=O)N(C1=O)CCC[N+](C)(C)CC2=CC=CC=C2

InChI

InChI=1S/C34H59N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-26-32-29-33(37)35(34(32)38)27-23-28-36(2,3)30-31-24-20-19-21-25-31/h19-21,24-25,32H,4-18,22-23,26-30H2,1-3H3/q+1