3,7-di(nonyl)naphthalene-1-sulfonic acid

Systemtic Name: 3,7-di(nonyl)naphthalene-1-sulfonic acid Openeye Name: 3,7-di(nonyl)naphthalene-1-sulfonic acid CAS Name: 3,7-di(nonyl)-1-naphthalenesulfonic acid IUPAC Name: 3,7-di(nonyl)naphthalene-1-sulfonic acid Traditional Name: 3,7-di(nonyl)naphthalene-1-sulfonic acid Formula: C28H44O3S MolecularWeight: 460.71216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC2=C(C=C(C=C2C=C1)CCCCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC1=CC2=C(C=C(C=C2C=C1)CCCCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C28H44O3S/c1-3-5-7-9-11-13-15-17-24-19-20-26-21-25(18-16-14-12-10-8-6-4-2)23-28(27(26)22-24)32(29,30)31/h19-23H,3-18H2,1-2H3,(H,29,30,31)