2-(4-bromophenyl)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]ethanamide

Systemtic Name: 2-(4-bromophenyl)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]ethanamide Openeye Name: 2-(4-bromophenyl)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]acetamide CAS Name: 2-(4-bromophenyl)-N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-(4-bromophenyl)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]acetamide Traditional Name: 2-(4-bromophenyl)-N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]acetamide Formula: C18H21BrN3O+ MolecularWeight: 375.28284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H20BrN3O/c19-16-6-3-14(4-7-16)11-18(23)21-13-15-5-8-17(20-12-15)22-9-1-2-10-22/h3-8,12H,1-2,9-11,13H2,(H,21,23)/p+1