2-[(2-chloranyl-4-phenyl-phenoxy)methyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[(2-chloranyl-4-phenyl-phenoxy)methyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[(2-chloro-4-phenyl-phenoxy)methyl]thiazole-4-carboxylic acid CAS Name: 2-[(2-chloro-4-phenylphenoxy)methyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[(2-chloro-4-phenylphenoxy)methyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[(2-chloro-4-phenyl-phenoxy)methyl]thiazole-4-carboxylic acid Formula: C17H12ClNO3S MolecularWeight: 345.80008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC3=NC(=CS3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC3=NC(=CS3)C(=O)O)Cl

InChI

InChI=1S/C17H12ClNO3S/c18-13-8-12(11-4-2-1-3-5-11)6-7-15(13)22-9-16-19-14(10-23-16)17(20)21/h1-8,10H,9H2,(H,20,21)