3-cyano-4-methyl-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-cyano-4-methyl-1-benzothiophene-2-carboxylic acid Openeye Name: 3-cyano-4-methyl-benzothiophene-2-carboxylic acid CAS Name: 3-cyano-4-methyl-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-cyano-4-methyl-1-benzothiophene-2-carboxylic acid Traditional Name: 3-cyano-4-methyl-benzothiophene-2-carboxylic acid Formula: C11H7NO2S MolecularWeight: 217.24378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=C2C#N)C(=O)O

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=C2C#N)C(=O)O

InChI

InChI=1S/C11H7NO2S/c1-6-3-2-4-8-9(6)7(5-12)10(15-8)11(13)14/h2-4H,1H3,(H,13,14)