methyl 2-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]sulfanylethanoate

Systemtic Name: methyl 2-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]sulfanylethanoate Openeye Name: methyl 2-(3,6-dioxocyclohexa-1,4-dien-1-yl)sulfanylacetate CAS Name: 2-[(3,6-dioxo-1-cyclohexa-1,4-dienyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3,6-dioxocyclohexa-1,4-dien-1-yl)sulfanylacetate Traditional Name: 2-[(3,6-diketocyclohexa-1,4-dien-1-yl)thio]acetic acid methyl ester Formula: C9H8O4S MolecularWeight: 212.22242

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=CC(=O)C=CC1=O

Isomeric SMILES

COC(=O)CSC1=CC(=O)C=CC1=O

InChI

InChI=1S/C9H8O4S/c1-13-9(12)5-14-8-4-6(10)2-3-7(8)11/h2-4H,5H2,1H3