phenyl 2-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-sulfonate

Systemtic Name: phenyl 2-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-sulfonate Openeye Name: phenyl 2-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-sulfonate CAS Name: 2-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-sulfonic acid phenyl ester IUPAC Name: phenyl 2-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-sulfonate Traditional Name: 2-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-sulfonic acid phenyl ester Formula: C25H22O6S MolecularWeight: 450.50358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3CC(C2O3)S(=O)(=O)OC4=CC=CC=C4)C5=CC=C(C=C5)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3CC(C2O3)S(=O)(=O)OC4=CC=CC=C4)C5=CC=C(C=C5)O

InChI

InChI=1S/C25H22O6S/c1-29-19-13-9-17(10-14-19)24-23(16-7-11-18(26)12-8-16)21-15-22(25(24)30-21)32(27,28)31-20-5-3-2-4-6-20/h2-14,21-22,25-26H,15H2,1H3