3-bromanyl-N-[2-oxidanylidene-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-oxidanylidene-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide Openeye Name: 3-bromo-N-[2-oxo-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide CAS Name: 3-bromo-N-[2-oxo-2-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methylamino]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-oxo-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide Traditional Name: 3-bromo-N-[2-keto-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]amino]ethyl]benzamide Formula: C21H25BrN3O2+ MolecularWeight: 431.3461

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)CNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)CNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H24BrN3O2/c22-19-9-5-8-16(12-19)21(27)24-14-20(26)23-13-17-6-1-2-7-18(17)15-25-10-3-4-11-25/h1-2,5-9,12H,3-4,10-11,13-15H2,(H,23,26)(H,24,27)/p+1