1-chloranylbenzo[e][1]benzothiole-2-carboxylic acid

Systemtic Name: 1-chloranylbenzo[e][1]benzothiole-2-carboxylic acid Openeye Name: 1-chlorobenzo[e]benzothiophene-2-carboxylic acid CAS Name: 1-chloro-2-benzo[e][1]benzothiolecarboxylic acid IUPAC Name: 1-chlorobenzo[e][1]benzothiole-2-carboxylic acid Traditional Name: 1-chlorobenzo[e]benzothiophene-2-carboxylic acid Formula: C13H7ClO2S MolecularWeight: 262.71148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=C(S3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=C(S3)C(=O)O)Cl

InChI

InChI=1S/C13H7ClO2S/c14-11-10-8-4-2-1-3-7(8)5-6-9(10)17-12(11)13(15)16/h1-6H,(H,15,16)