(2-bromophenyl)methyl-methyl-[2-oxidanylidene-2-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]azanium

Systemtic Name: (2-bromophenyl)methyl-methyl-[2-oxidanylidene-2-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]azanium Openeye Name: (2-bromophenyl)methyl-methyl-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)anilino]ethyl]ammonium CAS Name: (2-bromophenyl)methyl-methyl-[2-oxo-2-[3-(2-oxo-1-pyrrolidinyl)anilino]ethyl]ammonium IUPAC Name: (2-bromophenyl)methyl-methyl-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)anilino]ethyl]azanium Traditional Name: (2-bromobenzyl)-[2-keto-2-[3-(2-ketopyrrolidino)anilino]ethyl]-methyl-ammonium Formula: C20H23BrN3O2+ MolecularWeight: 417.31952

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1Br)CC(=O)NC2=CC=CC(=C2)N3CCCC3=O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1Br)CC(=O)NC2=CC=CC(=C2)N3CCCC3=O

InChI

InChI=1S/C20H22BrN3O2/c1-23(13-15-6-2-3-9-18(15)21)14-19(25)22-16-7-4-8-17(12-16)24-11-5-10-20(24)26/h2-4,6-9,12H,5,10-11,13-14H2,1H3,(H,22,25)/p+1