(5-ethanoyl-1H-indol-2-yl)methyl 2-(1-methylpyridin-1-ium-3-yl)ethanoate

Systemtic Name: (5-ethanoyl-1H-indol-2-yl)methyl 2-(1-methylpyridin-1-ium-3-yl)ethanoate Openeye Name: (5-acetyl-1H-indol-2-yl)methyl 2-(1-methylpyridin-1-ium-3-yl)acetate CAS Name: 2-(1-methyl-3-pyridin-1-iumyl)acetic acid (5-acetyl-1H-indol-2-yl)methyl ester IUPAC Name: (5-acetyl-1H-indol-2-yl)methyl 2-(1-methylpyridin-1-ium-3-yl)acetate Traditional Name: 2-(1-methylpyridin-1-ium-3-yl)acetic acid (5-acetyl-1H-indol-2-yl)methyl ester Formula: C19H19N2O3+ MolecularWeight: 323.36576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)NC(=C2)COC(=O)CC3=C[N+](=CC=C3)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)NC(=C2)COC(=O)CC3=C[N+](=CC=C3)C

InChI

InChI=1S/C19H18N2O3/c1-13(22)15-5-6-18-16(9-15)10-17(20-18)12-24-19(23)8-14-4-3-7-21(2)11-14/h3-7,9-11H,8,12H2,1-2H3/p+1