ethyl 2-[[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]sulfanylmethyl]-5-oxidanyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-[[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]sulfanylmethyl]-5-oxidanyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-[(3,6-dioxocyclohexa-1,4-dien-1-yl)sulfanylmethyl]-5-hydroxy-benzofuran-3-carboxylate CAS Name: 2-[[(3,6-dioxo-1-cyclohexa-1,4-dienyl)thio]methyl]-5-hydroxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3,6-dioxocyclohexa-1,4-dien-1-yl)sulfanylmethyl]-5-hydroxy-1-benzofuran-3-carboxylate Traditional Name: 2-[[(3,6-diketocyclohexa-1,4-dien-1-yl)thio]methyl]-5-hydroxy-benzofuran-3-carboxylic acid ethyl ester Formula: C18H14O6S MolecularWeight: 358.36516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3=CC(=O)C=CC3=O

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3=CC(=O)C=CC3=O

InChI

InChI=1S/C18H14O6S/c1-2-23-18(22)17-12-7-10(19)4-6-14(12)24-15(17)9-25-16-8-11(20)3-5-13(16)21/h3-8,19H,2,9H2,1H3