[3-(1-methylpyrrolidin-2-yl)pyridin-1-ium-1-yl]methyl ethanoate

Systemtic Name: [3-(1-methylpyrrolidin-2-yl)pyridin-1-ium-1-yl]methyl ethanoate Openeye Name: [3-(1-methylpyrrolidin-2-yl)pyridin-1-ium-1-yl]methyl acetate CAS Name: acetic acid [3-(1-methyl-2-pyrrolidinyl)-1-pyridin-1-iumyl]methyl ester IUPAC Name: [3-(1-methylpyrrolidin-2-yl)pyridin-1-ium-1-yl]methyl acetate Traditional Name: acetic acid [3-(1-methylpyrrolidin-2-yl)pyridin-1-ium-1-yl]methyl ester Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC[N+]1=CC=CC(=C1)C2CCCN2C

Isomeric SMILES

CC(=O)OC[N+]1=CC=CC(=C1)C2CCCN2C

InChI

InChI=1S/C13H19N2O2/c1-11(16)17-10-15-8-3-5-12(9-15)13-6-4-7-14(13)2/h3,5,8-9,13H,4,6-7,10H2,1-2H3/q+1