5-(azaniumylmethyl)-4,6-dimethyl-2-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: 5-(azaniumylmethyl)-4,6-dimethyl-2-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: 5-(azaniumylmethyl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxylate CAS Name: 5-(ammoniomethyl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxylate IUPAC Name: 5-(azaniumylmethyl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-(ammoniomethyl)-2-keto-4,6-dimethyl-1H-pyridine-3-carboxylate Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1C[NH3+])C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NC(=C1C[NH3+])C)C(=O)[O-]

InChI

InChI=1S/C9H12N2O3/c1-4-6(3-10)5(2)11-8(12)7(4)9(13)14/h3,10H2,1-2H3,(H,11,12)(H,13,14)