[1-(2-hydroxyphenyl)-2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl] naphthalene-1-sulfonate

Systemtic Name: [1-(2-hydroxyphenyl)-2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl] naphthalene-1-sulfonate Openeye Name: [2-hydroxy-1-(2-hydroxyphenyl)-2-methyl-3-oxo-3-phenyl-propyl] naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid [2-hydroxy-1-(2-hydroxyphenyl)-2-methyl-3-oxo-3-phenylpropyl] ester IUPAC Name: [2-hydroxy-1-(2-hydroxyphenyl)-2-methyl-3-oxo-3-phenylpropyl] naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid [2-hydroxy-1-(2-hydroxyphenyl)-3-keto-2-methyl-3-phenyl-propyl] ester Formula: C26H22O6S MolecularWeight: 462.51428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1O)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)(C(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C(C1=CC=CC=C1O)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)(C(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C26H22O6S/c1-26(29,24(28)19-11-3-2-4-12-19)25(21-15-7-8-16-22(21)27)32-33(30,31)23-17-9-13-18-10-5-6-14-20(18)23/h2-17,25,27,29H,1H3