2-(3-chloranyl-5-methoxy-4-phenethyloxy-phenyl)-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-(3-chloranyl-5-methoxy-4-phenethyloxy-phenyl)-1,3-thiazole-4-carboxylic acid Openeye Name: 2-(3-chloro-5-methoxy-4-phenethyloxy-phenyl)thiazole-4-carboxylic acid CAS Name: 2-(3-chloro-5-methoxy-4-phenethyloxyphenyl)-4-thiazolecarboxylic acid IUPAC Name: 2-(3-chloro-5-methoxy-4-phenethyloxyphenyl)-1,3-thiazole-4-carboxylic acid Traditional Name: 2-(3-chloro-5-methoxy-4-phenethyloxy-phenyl)thiazole-4-carboxylic acid Formula: C19H16ClNO4S MolecularWeight: 389.85264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=NC(=CS2)C(=O)O)Cl)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=NC(=CS2)C(=O)O)Cl)OCCC3=CC=CC=C3

InChI

InChI=1S/C19H16ClNO4S/c1-24-16-10-13(18-21-15(11-26-18)19(22)23)9-14(20)17(16)25-8-7-12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3,(H,22,23)