4-[2-(4-carboxyphenyl)sulfonyloxyethoxysulfonyl]benzoic acid

Systemtic Name: 4-[2-(4-carboxyphenyl)sulfonyloxyethoxysulfonyl]benzoic acid Openeye Name: 4-[2-(4-carboxyphenyl)sulfonyloxyethoxysulfonyl]benzoic acid CAS Name: 4-[2-(4-carboxyphenyl)sulfonyloxyethoxysulfonyl]benzoic acid IUPAC Name: 4-[2-(4-carboxyphenyl)sulfonyloxyethoxysulfonyl]benzoic acid Traditional Name: 4-[2-(4-carboxyphenyl)sulfonyloxyethoxysulfonyl]benzoic acid Formula: C16H14O10S2 MolecularWeight: 430.40636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14O10S2/c17-15(18)11-1-5-13(6-2-11)27(21,22)25-9-10-26-28(23,24)14-7-3-12(4-8-14)16(19)20/h1-8H,9-10H2,(H,17,18)(H,19,20)