4-(4-carboxy-2-sulfo-phenyl)-3-sulfo-benzoic acid

Systemtic Name: 4-(4-carboxy-2-sulfo-phenyl)-3-sulfo-benzoic acid Openeye Name: 4-(4-carboxy-2-sulfo-phenyl)-3-sulfo-benzoic acid CAS Name: 4-(4-carboxy-2-sulfophenyl)-3-sulfobenzoic acid IUPAC Name: 4-(4-carboxy-2-sulfophenyl)-3-sulfobenzoic acid Traditional Name: 4-(4-carboxy-2-sulfo-phenyl)-3-sulfo-benzoic acid Formula: C14H10O10S2 MolecularWeight: 402.3532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C2=C(C=C(C=C2)C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C2=C(C=C(C=C2)C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C14H10O10S2/c15-13(16)7-1-3-9(11(5-7)25(19,20)21)10-4-2-8(14(17)18)6-12(10)26(22,23)24/h1-6H,(H,15,16)(H,17,18)(H,19,20,21)(H,22,23,24)