4-[2-(4-sulfophenyl)ethyl]benzenesulfonic acid

Systemtic Name: 4-[2-(4-sulfophenyl)ethyl]benzenesulfonic acid Openeye Name: 4-[2-(4-sulfophenyl)ethyl]benzenesulfonic acid CAS Name: 4-[2-(4-sulfophenyl)ethyl]benzenesulfonic acid IUPAC Name: 4-[2-(4-sulfophenyl)ethyl]benzenesulfonic acid Traditional Name: 4-[2-(4-sulfophenyl)ethyl]besylic acid Formula: C14H14O6S2 MolecularWeight: 342.38736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C14H14O6S2/c15-21(16,17)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)22(18,19)20/h3-10H,1-2H2,(H,15,16,17)(H,18,19,20)