ethyl 3-isothiocyanato-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-isothiocyanato-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-isothiocyanatobenzofuran-2-carboxylate CAS Name: 3-isothiocyanato-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-isothiocyanato-1-benzofuran-2-carboxylate Traditional Name: 3-isothiocyanatocoumarilic acid ethyl ester Formula: C12H9NO3S MolecularWeight: 247.26976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)N=C=S

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)N=C=S

InChI

InChI=1S/C12H9NO3S/c1-2-15-12(14)11-10(13-7-17)8-5-3-4-6-9(8)16-11/h3-6H,2H2,1H3