5-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]oxy]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]oxy]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]oxy]benzene-1,3-dicarboxylic acid CAS Name: 5-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]oxy]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]oxy]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]oxy]isophthalic acid Formula: C16H8F3NO5S MolecularWeight: 383.29863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)OC3=CC(=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)OC3=CC(=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C16H8F3NO5S/c17-16(18,19)9-1-2-12-11(6-9)20-15(26-12)25-10-4-7(13(21)22)3-8(5-10)14(23)24/h1-6H,(H,21,22)(H,23,24)