ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-(cyanomethyl)benzofuran-2-carboxylate CAS Name: 5-(cyanomethyl)-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate Traditional Name: 5-(cyanomethyl)coumarilic acid ethyl ester Formula: C13H11NO3 MolecularWeight: 229.23134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)CC#N

Isomeric SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)CC#N

InChI

InChI=1S/C13H11NO3/c1-2-16-13(15)12-8-10-7-9(5-6-14)3-4-11(10)17-12/h3-4,7-8H,2,5H2,1H3