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

Systemtic Name: 4-[(4-chloranyl-3-ethyl-phenoxy)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(4-chloro-3-ethyl-phenoxy)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(4-chloro-3-ethylphenoxy)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(4-chloro-3-ethylphenoxy)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(4-chloro-3-ethyl-phenoxy)methyl]thiazole-2-carboxylic acid Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCC2=CSC(=N2)C(=O)O)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OCC2=CSC(=N2)C(=O)O)Cl

InChI

InChI=1S/C13H12ClNO3S/c1-2-8-5-10(3-4-11(8)14)18-6-9-7-19-12(15-9)13(16)17/h3-5,7H,2,6H2,1H3,(H,16,17)