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

Systemtic Name: methyl 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]ethanoate Openeye Name: methyl 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]acetate CAS Name: 2-[3-[2-(3-ethyl-1-pyridin-1-iumyl)ethyl]-1H-indol-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]acetate Traditional Name: 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]acetic acid methyl ester Formula: C20H23N2O2+ MolecularWeight: 323.40882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=CC=C1)CCC2=C(NC3=CC=CC=C32)CC(=O)OC

Isomeric SMILES

CCC1=C[N+](=CC=C1)CCC2=C(NC3=CC=CC=C32)CC(=O)OC

InChI

InChI=1S/C20H23N2O2/c1-3-15-7-6-11-22(14-15)12-10-17-16-8-4-5-9-18(16)21-19(17)13-20(23)24-2/h4-9,11,14,21H,3,10,12-13H2,1-2H3/q+1