ethyl 6-acetyloxy-2-(thiocyanatomethyl)-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-acetyloxy-2-(thiocyanatomethyl)-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-acetoxy-2-(thiocyanatomethyl)benzofuran-3-carboxylate CAS Name: 6-acetyloxy-2-(thiocyanatomethyl)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-acetyloxy-2-(thiocyanatomethyl)-1-benzofuran-3-carboxylate Traditional Name: 6-acetoxy-2-(thiocyanatomethyl)benzofuran-3-carboxylic acid ethyl ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=CC(=C2)OC(=O)C)CSC#N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=CC(=C2)OC(=O)C)CSC#N

InChI

InChI=1S/C15H13NO5S/c1-3-19-15(18)14-11-5-4-10(20-9(2)17)6-12(11)21-13(14)7-22-8-16/h4-6H,3,7H2,1-2H3