methyl 5-bromanyl-3-phenyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-phenyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-bromo-3-phenyl-benzothiophene-2-carboxylate CAS Name: 5-bromo-3-phenyl-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-phenyl-1-benzothiophene-2-carboxylate Traditional Name: 5-bromo-3-phenyl-benzothiophene-2-carboxylic acid methyl ester Formula: C16H11BrO2S MolecularWeight: 347.22634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=CC(=C2)Br)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=CC(=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C16H11BrO2S/c1-19-16(18)15-14(10-5-3-2-4-6-10)12-9-11(17)7-8-13(12)20-15/h2-9H,1H3