methyl 6-methyl-1-(2-oxidanylidenepropyl)pyridin-1-ium-3-carboxylate

Systemtic Name: methyl 6-methyl-1-(2-oxidanylidenepropyl)pyridin-1-ium-3-carboxylate Openeye Name: methyl 1-acetonyl-6-methyl-pyridin-1-ium-3-carboxylate CAS Name: 6-methyl-1-(2-oxopropyl)-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 6-methyl-1-(2-oxopropyl)pyridin-1-ium-3-carboxylate Traditional Name: 1-acetonyl-6-methyl-pyridin-1-ium-3-carboxylic acid methyl ester Formula: C11H14NO3+ MolecularWeight: 208.23376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)C(=O)OC)CC(=O)C

Isomeric SMILES

CC1=[N+](C=C(C=C1)C(=O)OC)CC(=O)C

InChI

InChI=1S/C11H14NO3/c1-8-4-5-10(11(14)15-3)7-12(8)6-9(2)13/h4-5,7H,6H2,1-3H3/q+1