3-nonylbenzene-1,2-disulfonic acid

Systemtic Name: 3-nonylbenzene-1,2-disulfonic acid Openeye Name: 3-nonylbenzene-1,2-disulfonic acid CAS Name: 3-nonylbenzene-1,2-disulfonic acid IUPAC Name: 3-nonylbenzene-1,2-disulfonic acid Traditional Name: 3-nonylbenzene-1,2-disulfonic acid Formula: C15H24O6S2 MolecularWeight: 364.47746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C15H24O6S2/c1-2-3-4-5-6-7-8-10-13-11-9-12-14(22(16,17)18)15(13)23(19,20)21/h9,11-12H,2-8,10H2,1H3,(H,16,17,18)(H,19,20,21)