1-[2-(1,6-dimethylpyridin-1-ium-3-yl)ethyl]-2-methyl-3-phenyl-indole iodide

Systemtic Name: 1-[2-(1,6-dimethylpyridin-1-ium-3-yl)ethyl]-2-methyl-3-phenyl-indole iodide Openeye Name: 1-[2-(1,6-dimethylpyridin-1-ium-3-yl)ethyl]-2-methyl-3-phenyl-indole iodide CAS Name: 1-[2-(1,6-dimethyl-3-pyridin-1-iumyl)ethyl]-2-methyl-3-phenylindole iodide IUPAC Name: 1-[2-(1,6-dimethylpyridin-1-ium-3-yl)ethyl]-2-methyl-3-phenylindole iodide Traditional Name: 1-[2-(1,6-dimethylpyridin-1-ium-3-yl)ethyl]-2-methyl-3-phenyl-indole iodide Formula: C24H25IN2 MolecularWeight: 468.37317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)CCN2C(=C(C3=CC=CC=C32)C4=CC=CC=C4)C)C.[I-]

Isomeric SMILES

CC1=[N+](C=C(C=C1)CCN2C(=C(C3=CC=CC=C32)C4=CC=CC=C4)C)C.[I-]

InChI

InChI=1S/C24H25N2.HI/c1-18-13-14-20(17-25(18)3)15-16-26-19(2)24(21-9-5-4-6-10-21)22-11-7-8-12-23(22)26;/h4-14,17H,15-16H2,1-3H3;1H/q+1;/p-1