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

Systemtic Name: 3,4-diethylnaphthalene-1,2-disulfonic acid Openeye Name: 3,4-diethylnaphthalene-1,2-disulfonic acid CAS Name: 3,4-diethylnaphthalene-1,2-disulfonic acid IUPAC Name: 3,4-diethylnaphthalene-1,2-disulfonic acid Traditional Name: 3,4-diethylnaphthalene-1,2-disulfonic acid Formula: C14H16O6S2 MolecularWeight: 344.40324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)CC

Isomeric SMILES

CCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)CC

InChI

InChI=1S/C14H16O6S2/c1-3-9-10(4-2)13(21(15,16)17)14(22(18,19)20)12-8-6-5-7-11(9)12/h5-8H,3-4H2,1-2H3,(H,15,16,17)(H,18,19,20)