sodium 6-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]-1H-pyrimidine-5-carboxylate

Systemtic Name: sodium 6-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]-1H-pyrimidine-5-carboxylate Openeye Name: sodium 6-oxo-2-[3-(trifluoromethyl)anilino]-1H-pyrimidine-5-carboxylate CAS Name: sodium 6-oxo-2-[3-(trifluoromethyl)anilino]-1H-pyrimidine-5-carboxylate IUPAC Name: sodium 6-oxo-2-[3-(trifluoromethyl)anilino]-1H-pyrimidine-5-carboxylate Traditional Name: sodium 6-keto-2-[3-(trifluoromethyl)anilino]-1H-pyrimidine-5-carboxylate Formula: C12H7F3N3NaO3 MolecularWeight: 321.18726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=C(C(=O)N2)C(=O)[O-])C(F)(F)F.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=C(C(=O)N2)C(=O)[O-])C(F)(F)F.[Na+]

InChI

InChI=1S/C12H8F3N3O3.Na/c13-12(14,15)6-2-1-3-7(4-6)17-11-16-5-8(10(20)21)9(19)18-11;/h1-5H,(H,20,21)(H2,16,17,18,19);/q;+1/p-1