methyl 2-(2-phenylsulfanylethyl)-1-benzofuran-6-carboxylate

Systemtic Name: methyl 2-(2-phenylsulfanylethyl)-1-benzofuran-6-carboxylate Openeye Name: methyl 2-(2-phenylsulfanylethyl)benzofuran-6-carboxylate CAS Name: 2-[2-(phenylthio)ethyl]-6-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-(2-phenylsulfanylethyl)-1-benzofuran-6-carboxylate Traditional Name: 2-[2-(phenylthio)ethyl]benzofuran-6-carboxylic acid methyl ester Formula: C18H16O3S MolecularWeight: 312.38284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C=C(O2)CCSC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C=C(O2)CCSC3=CC=CC=C3

InChI

InChI=1S/C18H16O3S/c1-20-18(19)14-8-7-13-11-15(21-17(13)12-14)9-10-22-16-5-3-2-4-6-16/h2-8,11-12H,9-10H2,1H3