4-[(4-chloranyl-2-methyl-phenoxy)methyl]thiophene-2-carboxylic acid

Systemtic Name: 4-[(4-chloranyl-2-methyl-phenoxy)methyl]thiophene-2-carboxylic acid Openeye Name: 4-[(4-chloro-2-methyl-phenoxy)methyl]thiophene-2-carboxylic acid CAS Name: 4-[(4-chloro-2-methylphenoxy)methyl]-2-thiophenecarboxylic acid IUPAC Name: 4-[(4-chloro-2-methylphenoxy)methyl]thiophene-2-carboxylic acid Traditional Name: 4-[(4-chloro-2-methyl-phenoxy)methyl]-2-thenoic acid Formula: C13H11ClO3S MolecularWeight: 282.74264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC2=CSC(=C2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC2=CSC(=C2)C(=O)O

InChI

InChI=1S/C13H11ClO3S/c1-8-4-10(14)2-3-11(8)17-6-9-5-12(13(15)16)18-7-9/h2-5,7H,6H2,1H3,(H,15,16)