sodium 1-ethyl-4-oxidanylidene-2,6-diphenyl-pyridine-3-carboxylate

Systemtic Name: sodium 1-ethyl-4-oxidanylidene-2,6-diphenyl-pyridine-3-carboxylate Openeye Name: sodium 1-ethyl-4-oxo-2,6-diphenyl-pyridine-3-carboxylate CAS Name: sodium 1-ethyl-4-oxo-2,6-diphenyl-3-pyridinecarboxylate IUPAC Name: sodium 1-ethyl-4-oxo-2,6-diphenylpyridine-3-carboxylate Traditional Name: sodium 1-ethyl-4-keto-2,6-diphenyl-nicotinate Formula: C20H16NNaO3 MolecularWeight: 341.33571

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=O)C(=C1C2=CC=CC=C2)C(=O)[O-])C3=CC=CC=C3.[Na+]

Isomeric SMILES

CCN1C(=CC(=O)C(=C1C2=CC=CC=C2)C(=O)[O-])C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C20H17NO3.Na/c1-2-21-16(14-9-5-3-6-10-14)13-17(22)18(20(23)24)19(21)15-11-7-4-8-12-15;/h3-13H,2H2,1H3,(H,23,24);/q;+1/p-1