(4-bromanyl-3-methyl-phenyl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (4-bromanyl-3-methyl-phenyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (4-bromo-3-methyl-phenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (4-bromo-3-methylphenyl) ester IUPAC Name: (4-bromo-3-methylphenyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (4-bromo-3-methyl-phenyl) ester Formula: C16H10BrClO2S MolecularWeight: 381.6714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

InChI

InChI=1S/C16H10BrClO2S/c1-9-8-10(6-7-12(9)17)20-16(19)15-14(18)11-4-2-3-5-13(11)21-15/h2-8H,1H3