(4-propan-2-ylphenyl) 4-oxidanylnaphthalene-1-sulfonate

Systemtic Name: (4-propan-2-ylphenyl) 4-oxidanylnaphthalene-1-sulfonate Openeye Name: (4-isopropylphenyl) 4-hydroxynaphthalene-1-sulfonate CAS Name: 4-hydroxy-1-naphthalenesulfonic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 4-hydroxynaphthalene-1-sulfonate Traditional Name: 4-hydroxynaphthalene-1-sulfonic acid p-cumenyl ester Formula: C19H18O4S MolecularWeight: 342.40882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)O

InChI

InChI=1S/C19H18O4S/c1-13(2)14-7-9-15(10-8-14)23-24(21,22)19-12-11-18(20)16-5-3-4-6-17(16)19/h3-13,20H,1-2H3