methyl-(4-methylphenyl)-[3-(octadecanoylamino)propyl]-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium

Systemtic Name: methyl-(4-methylphenyl)-[3-(octadecanoylamino)propyl]-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium Openeye Name: methyl-[3-(octadecanoylamino)propyl]-[(2-oxopyrrolidin-1-yl)methyl]-(p-tolyl)ammonium CAS Name: methyl-(4-methylphenyl)-[3-(1-oxooctadecylamino)propyl]-[(2-oxo-1-pyrrolidinyl)methyl]ammonium IUPAC Name: methyl-(4-methylphenyl)-[3-(octadecanoylamino)propyl]-[(2-oxopyrrolidin-1-yl)methyl]azanium Traditional Name: (2-ketopyrrolidino)methyl-methyl-(p-tolyl)-(3-stearamidopropyl)ammonium Formula: C34H60N3O2+ MolecularWeight: 542.8591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(CN1CCCC1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(CN1CCCC1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C34H59N3O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-33(38)35-27-20-29-37(3,30-36-28-19-22-34(36)39)32-25-23-31(2)24-26-32/h23-26H,4-22,27-30H2,1-3H3/p+1