8-bromanyl-2-methyl-benzo[e][1]benzothiole-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-methyl-benzo[e][1]benzothiole-4-carboxylic acid Openeye Name: 8-bromo-2-methyl-benzo[e]benzothiophene-4-carboxylic acid CAS Name: 8-bromo-2-methyl-4-benzo[e][1]benzothiolecarboxylic acid IUPAC Name: 8-bromo-2-methylbenzo[e][1]benzothiole-4-carboxylic acid Traditional Name: 8-bromo-2-methyl-benzo[e]benzothiophene-4-carboxylic acid Formula: C14H9BrO2S MolecularWeight: 321.18906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C3C=C(C=CC3=CC(=C2S1)C(=O)O)Br

Isomeric SMILES

CC1=CC2=C3C=C(C=CC3=CC(=C2S1)C(=O)O)Br

InChI

InChI=1S/C14H9BrO2S/c1-7-4-11-10-6-9(15)3-2-8(10)5-12(14(16)17)13(11)18-7/h2-6H,1H3,(H,16,17)