2-methylpropyl 1-methylpyridin-1-ium-4-carboxylate

Systemtic Name: 2-methylpropyl 1-methylpyridin-1-ium-4-carboxylate Openeye Name: isobutyl 1-methylpyridin-1-ium-4-carboxylate CAS Name: 1-methyl-4-pyridin-1-iumcarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-methylpyridin-1-ium-4-carboxylate Traditional Name: 1-methylpyridin-1-ium-4-carboxylic acid isobutyl ester Formula: C11H16NO2+ MolecularWeight: 194.25024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=[N+](C=C1)C

Isomeric SMILES

CC(C)COC(=O)C1=CC=[N+](C=C1)C

InChI

InChI=1S/C11H16NO2/c1-9(2)8-14-11(13)10-4-6-12(3)7-5-10/h4-7,9H,8H2,1-3H3/q+1