3-(2,2'-spirobi[chromene]-3'-ylmethoxymethyl)benzenesulfonic acid

Systemtic Name: 3-(2,2'-spirobi[chromene]-3'-ylmethoxymethyl)benzenesulfonic acid Openeye Name: 3-(2,2'-spirobi[chromene]-3'-ylmethoxymethyl)benzenesulfonic acid CAS Name: 3-(2,2'-spirobi[1-benzopyran]-3'-ylmethoxymethyl)benzenesulfonic acid IUPAC Name: 3-(2,2'-spirobi[chromene]-3'-ylmethoxymethyl)benzenesulfonic acid Traditional Name: 3-(2,2'-spirobi[chromene]-3'-ylmethoxymethyl)besylic acid Formula: C25H20O6S MolecularWeight: 448.4877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3(O2)C(=CC4=CC=CC=C4O3)COCC5=CC(=CC=C5)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3(O2)C(=CC4=CC=CC=C4O3)COCC5=CC(=CC=C5)S(=O)(=O)O

InChI

InChI=1S/C25H20O6S/c26-32(27,28)22-9-5-6-18(14-22)16-29-17-21-15-20-8-2-4-11-24(20)31-25(21)13-12-19-7-1-3-10-23(19)30-25/h1-15H,16-17H2,(H,26,27,28)