4-chloranyl-3-phenyl-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-chloranyl-3-phenyl-1,2-thiazole-5-carboxylic acid Openeye Name: 4-chloro-3-phenyl-isothiazole-5-carboxylic acid CAS Name: 4-chloro-3-phenyl-5-isothiazolecarboxylic acid IUPAC Name: 4-chloro-3-phenyl-1,2-thiazole-5-carboxylic acid Traditional Name: 4-chloro-3-phenyl-isothiazole-5-carboxylic acid Formula: C10H6ClNO2S MolecularWeight: 239.67814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NSC(=C2Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NSC(=C2Cl)C(=O)O

InChI

InChI=1S/C10H6ClNO2S/c11-7-8(6-4-2-1-3-5-6)12-15-9(7)10(13)14/h1-5H,(H,13,14)