methyl-[3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]propyl]ammonium CAS Name: methyl-[3-[[oxo-[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]amino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]propyl]azanium Traditional Name: benzyl-[3-[[4-(2-ketopyrrolidino)benzoyl]amino]propyl]-methyl-ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC=C(C=C1)N2CCCC2=O)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC=C(C=C1)N2CCCC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-24(17-18-7-3-2-4-8-18)15-6-14-23-22(27)19-10-12-20(13-11-19)25-16-5-9-21(25)26/h2-4,7-8,10-13H,5-6,9,14-17H2,1H3,(H,23,27)/p+1