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

Systemtic Name: N-(3-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propanamide chloride Openeye Name: N-(3-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propanamide chloride CAS Name: N-(3-bromophenyl)-3-(1-pyrrolidin-1-iumyl)propanamide chloride IUPAC Name: N-(3-bromophenyl)-3-pyrrolidin-1-ium-1-ylpropanamide chloride Traditional Name: N-(3-bromophenyl)-3-pyrrolidin-1-ium-1-yl-propionamide chloride Formula: C13H18BrClN2O MolecularWeight: 333.65182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC(=O)NC2=CC(=CC=C2)Br.[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=CC(=CC=C2)Br.[Cl-]

InChI

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