2-methylpropyl 1-oxidanidylpyridin-1-ium-3-carboxylate

Systemtic Name: 2-methylpropyl 1-oxidanidylpyridin-1-ium-3-carboxylate Openeye Name: isobutyl 1-oxidopyridin-1-ium-3-carboxylate CAS Name: 1-oxido-3-pyridin-1-iumcarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-oxidopyridin-1-ium-3-carboxylate Traditional Name: 1-oxidopyridin-1-ium-3-carboxylic acid isobutyl ester Formula: C10H13NO3 MolecularWeight: 195.21512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO3/c1-8(2)7-14-10(12)9-4-3-5-11(13)6-9/h3-6,8H,7H2,1-2H3