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

Systemtic Name: sodium 4-[[5-chloranyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,3-thiazole-2-carboxylate Openeye Name: sodium 4-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]thiazole-2-carboxylate CAS Name: sodium 4-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-thiazolecarboxylate IUPAC Name: sodium 4-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,3-thiazole-2-carboxylate Traditional Name: sodium 4-[5-chloro-2-(4-fluorobenzyl)oxy-benzyl]thiazole-2-carboxylate Formula: C18H12ClFNNaO3S MolecularWeight: 399.798953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=C(C=C(C=C2)Cl)CC3=CSC(=N3)C(=O)[O-])F.[Na+]

Isomeric SMILES

C1=CC(=CC=C1COC2=C(C=C(C=C2)Cl)CC3=CSC(=N3)C(=O)[O-])F.[Na+]

InChI

InChI=1S/C18H13ClFNO3S.Na/c19-13-3-6-16(24-9-11-1-4-14(20)5-2-11)12(7-13)8-15-10-25-17(21-15)18(22)23;/h1-7,10H,8-9H2,(H,22,23);/q;+1/p-1