sodium 2-[[2-[(4-fluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: sodium 2-[[2-[(4-fluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxylate Openeye Name: sodium 2-[[2-[(4-fluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]methyl]thiazole-4-carboxylate CAS Name: sodium 2-[[2-[(4-fluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]methyl]-4-thiazolecarboxylate IUPAC Name: sodium 2-[[2-[(4-fluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxylate Traditional Name: sodium 2-[2-(4-fluorobenzyl)oxy-5-(trifluoromethyl)benzyl]thiazole-4-carboxylate Formula: C19H12F4NNaO3S MolecularWeight: 433.351863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=C(C=C(C=C2)C(F)(F)F)CC3=NC(=CS3)C(=O)[O-])F.[Na+]

Isomeric SMILES

C1=CC(=CC=C1COC2=C(C=C(C=C2)C(F)(F)F)CC3=NC(=CS3)C(=O)[O-])F.[Na+]

InChI

InChI=1S/C19H13F4NO3S.Na/c20-14-4-1-11(2-5-14)9-27-16-6-3-13(19(21,22)23)7-12(16)8-17-24-15(10-28-17)18(25)26;/h1-7,10H,8-9H2,(H,25,26);/q;+1/p-1