sodium 1-ethyl-2,6-dimethyl-4-oxidanylidene-5-phenyl-pyridine-3-carboxylate

Systemtic Name: sodium 1-ethyl-2,6-dimethyl-4-oxidanylidene-5-phenyl-pyridine-3-carboxylate Openeye Name: sodium 1-ethyl-2,6-dimethyl-4-oxo-5-phenyl-pyridine-3-carboxylate CAS Name: sodium 1-ethyl-2,6-dimethyl-4-oxo-5-phenyl-3-pyridinecarboxylate IUPAC Name: sodium 1-ethyl-2,6-dimethyl-4-oxo-5-phenylpyridine-3-carboxylate Traditional Name: sodium 1-ethyl-4-keto-2,6-dimethyl-5-phenyl-nicotinate Formula: C16H16NNaO3 MolecularWeight: 293.29291

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)C(=C1C)C(=O)[O-])C2=CC=CC=C2)C.[Na+]

Isomeric SMILES

CCN1C(=C(C(=O)C(=C1C)C(=O)[O-])C2=CC=CC=C2)C.[Na+]

InChI

InChI=1S/C16H17NO3.Na/c1-4-17-10(2)13(12-8-6-5-7-9-12)15(18)14(11(17)3)16(19)20;/h5-9H,4H2,1-3H3,(H,19,20);/q;+1/p-1