(4-bromanyl-2-chloranyl-phenyl) 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-bromo-2-chloro-phenyl) 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid (4-bromo-2-chloro-phenyl) ester Formula: C17H12BrClO4 MolecularWeight: 395.63178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C17H12BrClO4/c1-9-12-8-11(21-2)4-6-14(12)22-16(9)17(20)23-15-5-3-10(18)7-13(15)19/h3-8H,1-2H3