6-(2-carboxyphenyl)-4-sulfonyl-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 6-(2-carboxyphenyl)-4-sulfonyl-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 6-(2-carboxyphenyl)-4-sulfonyl-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 6-(2-carboxyphenyl)-4-sulfonyl-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 6-(2-carboxyphenyl)-4-sulfonylcyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 6-(2-carboxyphenyl)-4-sulfonyl-cyclohexa-1,5-diene-1-carboxylic acid Formula: C14H10O6S MolecularWeight: 306.2906

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(=CC1=S(=O)=O)C2=CC=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

C1C=C(C(=CC1=S(=O)=O)C2=CC=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C14H10O6S/c15-13(16)10-4-2-1-3-9(10)12-7-8(21(19)20)5-6-11(12)14(17)18/h1-4,6-7H,5H2,(H,15,16)(H,17,18)