5-chloranyl-3-(hydroxymethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-(hydroxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 5-chloro-3-(hydroxymethyl)benzothiophene-2-carboxylic acid CAS Name: 5-chloro-3-(hydroxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 5-chloro-3-(hydroxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 5-chloro-3-methylol-benzothiophene-2-carboxylic acid Formula: C10H7ClO3S MolecularWeight: 242.67878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=C(S2)C(=O)O)CO

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=C(S2)C(=O)O)CO

InChI

InChI=1S/C10H7ClO3S/c11-5-1-2-8-6(3-5)7(4-12)9(15-8)10(13)14/h1-3,12H,4H2,(H,13,14)