dimethyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-[2-(undecanoylamino)phenyl]azanium chloride

Systemtic Name: dimethyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-[2-(undecanoylamino)phenyl]azanium chloride Openeye Name: dimethyl-[(2-oxopyrrolidin-1-yl)methyl]-[2-(undecanoylamino)phenyl]ammonium chloride CAS Name: dimethyl-[(2-oxo-1-pyrrolidinyl)methyl]-[2-(1-oxoundecylamino)phenyl]ammonium chloride IUPAC Name: dimethyl-[(2-oxopyrrolidin-1-yl)methyl]-[2-(undecanoylamino)phenyl]azanium chloride Traditional Name: (2-ketopyrrolidino)methyl-dimethyl-[2-(undecanoylamino)phenyl]ammonium chloride Formula: C24H40ClN3O2 MolecularWeight: 438.0463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)NC1=CC=CC=C1[N+](C)(C)CN2CCCC2=O.[Cl-]

Isomeric SMILES

CCCCCCCCCCC(=O)NC1=CC=CC=C1[N+](C)(C)CN2CCCC2=O.[Cl-]

InChI

InChI=1S/C24H39N3O2.ClH/c1-4-5-6-7-8-9-10-11-17-23(28)25-21-15-12-13-16-22(21)27(2,3)20-26-19-14-18-24(26)29;/h12-13,15-16H,4-11,14,17-20H2,1-3H3;1H