8-hexyl-5-methyl-naphthalene-2-sulfonic acid

Systemtic Name: 8-hexyl-5-methyl-naphthalene-2-sulfonic acid Openeye Name: 8-hexyl-5-methyl-naphthalene-2-sulfonic acid CAS Name: 8-hexyl-5-methyl-2-naphthalenesulfonic acid IUPAC Name: 8-hexyl-5-methylnaphthalene-2-sulfonic acid Traditional Name: 8-hexyl-5-methyl-naphthalene-2-sulfonic acid Formula: C17H22O3S MolecularWeight: 306.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=C(C=CC2=C(C=C1)C)S(=O)(=O)O

Isomeric SMILES

CCCCCCC1=C2C=C(C=CC2=C(C=C1)C)S(=O)(=O)O

InChI

InChI=1S/C17H22O3S/c1-3-4-5-6-7-14-9-8-13(2)16-11-10-15(12-17(14)16)21(18,19)20/h8-12H,3-7H2,1-2H3,(H,18,19,20)