ethyl 5-oxidanyl-2-(phenylsulfanylmethyl)-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-oxidanyl-2-(phenylsulfanylmethyl)-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-(phenylsulfanylmethyl)benzofuran-3-carboxylate CAS Name: 5-hydroxy-2-[(phenylthio)methyl]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-(phenylsulfanylmethyl)-1-benzofuran-3-carboxylate Traditional Name: 5-hydroxy-2-[(phenylthio)methyl]benzofuran-3-carboxylic acid ethyl ester Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3=CC=CC=C3

InChI

InChI=1S/C18H16O4S/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)22-16(17)11-23-13-6-4-3-5-7-13/h3-10,19H,2,11H2,1H3