[2-[[[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[[4-chloro-3-(2-oxo-1-pyrrolidinyl)phenyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[4-chloro-3-(2-ketopyrrolidino)benzoyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)Cl)N3CCCC3=O

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)Cl)N3CCCC3=O

InChI

InChI=1S/C21H24ClN3O2/c1-24(2)14-17-7-4-3-6-16(17)13-23-21(27)15-9-10-18(22)19(12-15)25-11-5-8-20(25)26/h3-4,6-7,9-10,12H,5,8,11,13-14H2,1-2H3,(H,23,27)/p+1