3-[(1-ethylpyridin-1-ium-3-yl)methyl]-5-methyl-1H-indole bromide

Systemtic Name: 3-[(1-ethylpyridin-1-ium-3-yl)methyl]-5-methyl-1H-indole bromide Openeye Name: 3-[(1-ethylpyridin-1-ium-3-yl)methyl]-5-methyl-1H-indole bromide CAS Name: 3-[(1-ethyl-3-pyridin-1-iumyl)methyl]-5-methyl-1H-indole bromide IUPAC Name: 3-[(1-ethylpyridin-1-ium-3-yl)methyl]-5-methyl-1H-indole bromide Traditional Name: 3-[(1-ethylpyridin-1-ium-3-yl)methyl]-5-methyl-1H-indole bromide Formula: C17H19BrN2 MolecularWeight: 331.25016

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1)CC2=CNC3=C2C=C(C=C3)C.[Br-]

Isomeric SMILES

CC[N+]1=CC=CC(=C1)CC2=CNC3=C2C=C(C=C3)C.[Br-]

InChI

InChI=1S/C17H19N2.BrH/c1-3-19-8-4-5-14(12-19)10-15-11-18-17-7-6-13(2)9-16(15)17;/h4-9,11-12,18H,3,10H2,1-2H3;1H/q+1;/p-1