2-[4-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide

Systemtic Name: 2-[4-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[4-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide CAS Name: 2-[4-[2-(1H-indol-3-yl)ethyl]-1-pyridin-1-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[4-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-1-yl]-1-phenylethanone bromide Traditional Name: 2-[4-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Formula: C23H21BrN2O MolecularWeight: 421.32964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)CCC3=CNC4=CC=CC=C43.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)CCC3=CNC4=CC=CC=C43.[Br-]

InChI

InChI=1S/C23H21N2O.BrH/c26-23(19-6-2-1-3-7-19)17-25-14-12-18(13-15-25)10-11-20-16-24-22-9-5-4-8-21(20)22;/h1-9,12-16,24H,10-11,17H2;1H/q+1;/p-1