3-ethylsulfanyl-6-methyl-phthalic acid

Systemtic Name: 3-ethylsulfanyl-6-methyl-phthalic acid Openeye Name: 3-ethylsulfanyl-6-methyl-phthalic acid CAS Name: 3-(ethylthio)-6-methylphthalic acid IUPAC Name: 3-ethylsulfanyl-6-methylphthalic acid Traditional Name: 3-(ethylthio)-6-methyl-phthalic acid Formula: C11H12O4S MolecularWeight: 240.27558

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=C(C=C1)C)C(=O)O)C(=O)O

Isomeric SMILES

CCSC1=C(C(=C(C=C1)C)C(=O)O)C(=O)O

InChI

InChI=1S/C11H12O4S/c1-3-16-7-5-4-6(2)8(10(12)13)9(7)11(14)15/h4-5H,3H2,1-2H3,(H,12,13)(H,14,15)