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

Systemtic Name: (2-bromanyl-4-tert-butyl-phenyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-bromo-4-tert-butyl-phenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (2-bromo-4-tert-butylphenyl) ester IUPAC Name: (2-bromo-4-tert-butylphenyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2-bromo-4-tert-butyl-phenyl) ester Formula: C19H16BrClO2S MolecularWeight: 423.75114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrClO2S/c1-19(2,3)11-8-9-14(13(20)10-11)23-18(22)17-16(21)12-6-4-5-7-15(12)24-17/h4-10H,1-3H3