2-docosoxyethyl-methyl-(4-methylphenyl)-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride

Systemtic Name: 2-docosoxyethyl-methyl-(4-methylphenyl)-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride Openeye Name: 2-docosoxyethyl-methyl-[(2-oxopyrrolidin-1-yl)methyl]-(p-tolyl)ammonium chloride CAS Name: 2-docosoxyethyl-methyl-(4-methylphenyl)-[(2-oxo-1-pyrrolidinyl)methyl]ammonium chloride IUPAC Name: 2-docosoxyethyl-methyl-(4-methylphenyl)-[(2-oxopyrrolidin-1-yl)methyl]azanium chloride Traditional Name: 2-behenyloxyethyl-[(2-ketopyrrolidino)methyl]-methyl-(p-tolyl)ammonium chloride Formula: C37H67ClN2O2 MolecularWeight: 607.39308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOCC[N+](C)(CN1CCCC1=O)C2=CC=C(C=C2)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOCC[N+](C)(CN1CCCC1=O)C2=CC=C(C=C2)C.[Cl-]

InChI

InChI=1S/C37H67N2O2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-32-41-33-31-39(3,34-38-30-24-25-37(38)40)36-28-26-35(2)27-29-36;/h26-29H,4-25,30-34H2,1-3H3;1H/q+1;/p-1