2-[1-(5-chloranyl-2-phenylmethoxy-phenyl)ethyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[1-(5-chloranyl-2-phenylmethoxy-phenyl)ethyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[1-(2-benzyloxy-5-chloro-phenyl)ethyl]thiazole-4-carboxylic acid CAS Name: 2-[1-(5-chloro-2-phenylmethoxyphenyl)ethyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[1-(5-chloro-2-phenylmethoxyphenyl)ethyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[1-(2-benzoxy-5-chloro-phenyl)ethyl]thiazole-4-carboxylic acid Formula: C19H16ClNO3S MolecularWeight: 373.85324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)Cl)OCC2=CC=CC=C2)C3=NC(=CS3)C(=O)O

Isomeric SMILES

CC(C1=C(C=CC(=C1)Cl)OCC2=CC=CC=C2)C3=NC(=CS3)C(=O)O

InChI

InChI=1S/C19H16ClNO3S/c1-12(18-21-16(11-25-18)19(22)23)15-9-14(20)7-8-17(15)24-10-13-5-3-2-4-6-13/h2-9,11-12H,10H2,1H3,(H,22,23)