(2-bromanyl-4-propan-2-yl-phenyl) 3-chloranyl-6-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: (2-bromanyl-4-propan-2-yl-phenyl) 3-chloranyl-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: (2-bromo-4-isopropyl-phenyl) 3-chloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-methoxy-1-benzothiophene-2-carboxylic acid (2-bromo-4-propan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-propan-2-ylphenyl) 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-methoxy-benzothiophene-2-carboxylic acid (2-bromo-4-isopropyl-phenyl) ester Formula: C19H16BrClO3S MolecularWeight: 439.75054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl)Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl)Br

InChI

InChI=1S/C19H16BrClO3S/c1-10(2)11-4-7-15(14(20)8-11)24-19(22)18-17(21)13-6-5-12(23-3)9-16(13)25-18/h4-10H,1-3H3