3-methyl-5-phenylsulfanyl-phthalic acid

Systemtic Name: 3-methyl-5-phenylsulfanyl-phthalic acid Openeye Name: 3-methyl-5-phenylsulfanyl-phthalic acid CAS Name: 3-methyl-5-(phenylthio)phthalic acid IUPAC Name: 3-methyl-5-phenylsulfanylphthalic acid Traditional Name: 3-methyl-5-(phenylthio)phthalic acid Formula: C15H12O4S MolecularWeight: 288.31838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)SC2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)SC2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C15H12O4S/c1-9-7-11(20-10-5-3-2-4-6-10)8-12(14(16)17)13(9)15(18)19/h2-8H,1H3,(H,16,17)(H,18,19)