[1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-3-yl]methyl ethanoate bromide

Systemtic Name: [1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-3-yl]methyl ethanoate bromide Openeye Name: [1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-3-yl]methyl acetate bromide CAS Name: acetic acid [1-[2-(1H-indol-3-yl)ethyl]-3-pyridin-1-iumyl]methyl ester bromide IUPAC Name: [1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-3-yl]methyl acetate bromide Traditional Name: acetic acid [1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-3-yl]methyl ester bromide Formula: C18H19BrN2O2 MolecularWeight: 375.25966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C[N+](=CC=C1)CCC2=CNC3=CC=CC=C32.[Br-]

Isomeric SMILES

CC(=O)OCC1=C[N+](=CC=C1)CCC2=CNC3=CC=CC=C32.[Br-]

InChI

InChI=1S/C18H19N2O2.BrH/c1-14(21)22-13-15-5-4-9-20(12-15)10-8-16-11-19-18-7-3-2-6-17(16)18;/h2-7,9,11-12,19H,8,10,13H2,1H3;1H/q+1;/p-1