(4-bromanyl-2,6-dimethyl-phenyl) 3-chloranyl-6-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 3-chloranyl-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 3-chloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-methoxy-1-benzothiophene-2-carboxylic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-methoxy-benzothiophene-2-carboxylic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C18H14BrClO3S MolecularWeight: 425.72396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl)C)Br

InChI

InChI=1S/C18H14BrClO3S/c1-9-6-11(19)7-10(2)16(9)23-18(21)17-15(20)13-5-4-12(22-3)8-14(13)24-17/h4-8H,1-3H3