3,4-dioctylbenzene-1,2-disulfonic acid

Systemtic Name: 3,4-dioctylbenzene-1,2-disulfonic acid Openeye Name: 3,4-dioctylbenzene-1,2-disulfonic acid CAS Name: 3,4-dioctylbenzene-1,2-disulfonic acid IUPAC Name: 3,4-dioctylbenzene-1,2-disulfonic acid Traditional Name: 3,4-dioctylbenzene-1,2-disulfonic acid Formula: C22H38O6S2 MolecularWeight: 462.66352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)CCCCCCCC

InChI

InChI=1S/C22H38O6S2/c1-3-5-7-9-11-13-15-19-17-18-21(29(23,24)25)22(30(26,27)28)20(19)16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3,(H,23,24,25)(H,26,27,28)