3-chloranyl-6-(cyanomethoxy)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-chloranyl-6-(cyanomethoxy)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-chloro-6-(cyanomethoxy)benzothiophene-2-carboxylic acid CAS Name: 3-chloro-6-(cyanomethoxy)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-chloro-6-(cyanomethoxy)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-chloro-6-(cyanomethoxy)benzothiophene-2-carboxylic acid Formula: C11H6ClNO3S MolecularWeight: 267.68824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OCC#N)SC(=C2Cl)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1OCC#N)SC(=C2Cl)C(=O)O

InChI

InChI=1S/C11H6ClNO3S/c12-9-7-2-1-6(16-4-3-13)5-8(7)17-10(9)11(14)15/h1-2,5H,4H2,(H,14,15)