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

Systemtic Name: methyl 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]ethanoate perchlorate Openeye Name: methyl 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]acetate perchlorate CAS Name: 2-[3-[2-(3-ethyl-1-pyridin-1-iumyl)ethyl]-1H-indol-2-yl]acetic acid methyl ester perchlorate IUPAC Name: methyl 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]acetate perchlorate Traditional Name: 2-[3-[2-(3-ethylpyridin-1-ium-1-yl)ethyl]-1H-indol-2-yl]acetic acid methyl ester perchlorate Formula: C20H23ClN2O6 MolecularWeight: 422.85942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N2O2.ClHO4/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;2-1(3,4)5/h4-9,11,14,21H,3,10,12-13H2,1-2H3;(H,2,3,4,5)/q+1;/p-1