(2-bromanyl-4-cyano-6-ethoxy-phenyl) 1-benzofuran-2-carboxylate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 1-benzofuran-2-carboxylate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C18H12BrNO4 MolecularWeight: 386.19618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C18H12BrNO4/c1-2-22-15-8-11(10-20)7-13(19)17(15)24-18(21)16-9-12-5-3-4-6-14(12)23-16/h3-9H,2H2,1H3