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

Systemtic Name: 3,4-dibutylbenzene-1,2-disulfonic acid Openeye Name: 3,4-dibutylbenzene-1,2-disulfonic acid CAS Name: 3,4-dibutylbenzene-1,2-disulfonic acid IUPAC Name: 3,4-dibutylbenzene-1,2-disulfonic acid Traditional Name: 3,4-dibutylbenzene-1,2-disulfonic acid Formula: C14H22O6S2 MolecularWeight: 350.45088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)CCCC

Isomeric SMILES

CCCCC1=C(C(=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)CCCC

InChI

InChI=1S/C14H22O6S2/c1-3-5-7-11-9-10-13(21(15,16)17)14(22(18,19)20)12(11)8-6-4-2/h9-10H,3-8H2,1-2H3,(H,15,16,17)(H,18,19,20)