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

Systemtic Name: (2-bromanyl-4-ethyl-phenyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-bromo-4-ethyl-phenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (2-bromo-4-ethylphenyl) ester IUPAC Name: (2-bromo-4-ethylphenyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2-bromo-4-ethyl-phenyl) ester Formula: C17H12BrClO2S MolecularWeight: 395.69798

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

InChI

InChI=1S/C17H12BrClO2S/c1-2-10-7-8-13(12(18)9-10)21-17(20)16-15(19)11-5-3-4-6-14(11)22-16/h3-9H,2H2,1H3