3-(2,3-dicarboxyphenyl)sulfanylphthalic acid

Systemtic Name: 3-(2,3-dicarboxyphenyl)sulfanylphthalic acid Openeye Name: 3-(2,3-dicarboxyphenyl)sulfanylphthalic acid CAS Name: 3-[(2,3-dicarboxyphenyl)thio]phthalic acid IUPAC Name: 3-(2,3-dicarboxyphenyl)sulfanylphthalic acid Traditional Name: 3-[(2,3-dicarboxyphenyl)thio]phthalic acid Formula: C16H10O8S MolecularWeight: 362.3108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)SC2=CC=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)SC2=CC=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H10O8S/c17-13(18)7-3-1-5-9(11(7)15(21)22)25-10-6-2-4-8(14(19)20)12(10)16(23)24/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24)