N-(4-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propanamide

Systemtic Name: N-(4-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: N-(4-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propanamide CAS Name: N-(4-bromophenyl)-3-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: N-(4-bromophenyl)-3-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: N-(4-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propionamide Formula: C13H18BrN2O+ MolecularWeight: 298.19882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H17BrN2O/c14-11-3-5-12(6-4-11)15-13(17)7-10-16-8-1-2-9-16/h3-6H,1-2,7-10H2,(H,15,17)/p+1