diethyl 4-methyl-3-sulfanyl-benzene-1,2-dicarboxylate

Systemtic Name: diethyl 4-methyl-3-sulfanyl-benzene-1,2-dicarboxylate Openeye Name: diethyl 4-methyl-3-sulfanyl-benzene-1,2-dicarboxylate CAS Name: 3-mercapto-4-methylbenzene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-methyl-3-sulfanylbenzene-1,2-dicarboxylate Traditional Name: 3-mercapto-4-methyl-benzene-1,2-dicarboxylic acid diethyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1)C)S)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1)C)S)C(=O)OCC

InChI

InChI=1S/C13H16O4S/c1-4-16-12(14)9-7-6-8(3)11(18)10(9)13(15)17-5-2/h6-7,18H,4-5H2,1-3H3