methyl 9-methylsulfanyl-10-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-anthracene-2-carboxylate

Systemtic Name: methyl 9-methylsulfanyl-10-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-anthracene-2-carboxylate Openeye Name: methyl 10-hydroxy-9-methylsulfanyl-4-oxo-2,3-dihydro-1H-anthracene-2-carboxylate CAS Name: 10-hydroxy-9-(methylthio)-4-oxo-2,3-dihydro-1H-anthracene-2-carboxylic acid methyl ester IUPAC Name: methyl 10-hydroxy-9-methylsulfanyl-4-oxo-2,3-dihydro-1H-anthracene-2-carboxylate Traditional Name: 10-hydroxy-4-keto-9-(methylthio)-2,3-dihydro-1H-anthracene-2-carboxylic acid methyl ester Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=C(C3=CC=CC=C3C(=C2C(=O)C1)O)SC

Isomeric SMILES

COC(=O)C1CC2=C(C3=CC=CC=C3C(=C2C(=O)C1)O)SC

InChI

InChI=1S/C17H16O4S/c1-21-17(20)9-7-12-14(13(18)8-9)15(19)10-5-3-4-6-11(10)16(12)22-2/h3-6,9,19H,7-8H2,1-2H3