methyl 3-bromanyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate

Systemtic Name: methyl 3-bromanyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Openeye Name: methyl 3-bromo-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate CAS Name: 3-bromo-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylic acid methyl ester IUPAC Name: methyl 3-bromo-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Traditional Name: 3-bromo-4,5,6,7-tetrahydroisobenzothiophene-1-carboxylic acid methyl ester Formula: C10H11BrO2S MolecularWeight: 275.16214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCCCC2=C(S1)Br

Isomeric SMILES

COC(=O)C1=C2CCCCC2=C(S1)Br

InChI

InChI=1S/C10H11BrO2S/c1-13-10(12)8-6-4-2-3-5-7(6)9(11)14-8/h2-5H2,1H3