3-[1-(phenylmethyl)pyridin-1-ium-3-yl]-1H-indole bromide

Systemtic Name: 3-[1-(phenylmethyl)pyridin-1-ium-3-yl]-1H-indole bromide Openeye Name: 3-(1-benzylpyridin-1-ium-3-yl)-1H-indole bromide CAS Name: 3-[1-(phenylmethyl)-3-pyridin-1-iumyl]-1H-indole bromide IUPAC Name: 3-(1-benzylpyridin-1-ium-3-yl)-1H-indole bromide Traditional Name: 3-(1-benzylpyridin-1-ium-3-yl)-1H-indole bromide Formula: C20H17BrN2 MolecularWeight: 365.26638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C3=CNC4=CC=CC=C43.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C3=CNC4=CC=CC=C43.[Br-]

InChI

InChI=1S/C20H17N2.BrH/c1-2-7-16(8-3-1)14-22-12-6-9-17(15-22)19-13-21-20-11-5-4-10-18(19)20;/h1-13,15,21H,14H2;1H/q+1;/p-1