3-bromanyl-N-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]benzamide Openeye Name: 3-bromo-N-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]benzamide CAS Name: 3-bromo-N-[2-oxo-2-[4-(1-pyrrolidin-1-iumylmethyl)anilino]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]benzamide Traditional Name: 3-bromo-N-[2-keto-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]benzamide Formula: C20H23BrN3O2+ MolecularWeight: 417.31952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)CNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)CNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H22BrN3O2/c21-17-5-3-4-16(12-17)20(26)22-13-19(25)23-18-8-6-15(7-9-18)14-24-10-1-2-11-24/h3-9,12H,1-2,10-11,13-14H2,(H,22,26)(H,23,25)/p+1