methyl 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylate

Systemtic Name: methyl 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylate Openeye Name: methyl 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylate CAS Name: 2-(aminomethyl)-1-ethyl-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 2-(aminomethyl)-1-ethylpyridin-1-ium-3-carboxylate Traditional Name: 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylic acid methyl ester Formula: C10H15N2O2+ MolecularWeight: 195.2383

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1CN)C(=O)OC

Isomeric SMILES

CC[N+]1=CC=CC(=C1CN)C(=O)OC

InChI

InChI=1S/C10H15N2O2/c1-3-12-6-4-5-8(9(12)7-11)10(13)14-2/h4-6H,3,7,11H2,1-2H3/q+1