7-nitro-1-benzothiophene-2-carboxylic acid

Systemtic Name: 7-nitro-1-benzothiophene-2-carboxylic acid Openeye Name: 7-nitrobenzothiophene-2-carboxylic acid CAS Name: 7-nitro-1-benzothiophene-2-carboxylic acid IUPAC Name: 7-nitro-1-benzothiophene-2-carboxylic acid Traditional Name: 7-nitrobenzothiophene-2-carboxylic acid Formula: C9H5NO4S MolecularWeight: 223.2053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2)C(=O)O

InChI

InChI=1S/C9H5NO4S/c11-9(12)7-4-5-2-1-3-6(10(13)14)8(5)15-7/h1-4H,(H,11,12)