1-bromanylbenzo[e][1]benzothiole-2-carboxylate

Systemtic Name: 1-bromanylbenzo[e][1]benzothiole-2-carboxylate Openeye Name: 1-bromobenzo[e]benzothiophene-2-carboxylate CAS Name: 1-bromo-2-benzo[e][1]benzothiolecarboxylate IUPAC Name: 1-bromobenzo[e][1]benzothiole-2-carboxylate Traditional Name: 1-bromobenzo[e]benzothiophene-2-carboxylate Formula: C13H6BrO2S- MolecularWeight: 306.15454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=C(S3)C(=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=C(S3)C(=O)[O-])Br

InChI

InChI=1S/C13H7BrO2S/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)/p-1