(2-methylphenyl) 9,10-bis(oxidanylidene)anthracene-2-sulfonate

Systemtic Name: (2-methylphenyl) 9,10-bis(oxidanylidene)anthracene-2-sulfonate Openeye Name: o-tolyl 9,10-dioxoanthracene-2-sulfonate CAS Name: 9,10-dioxo-2-anthracenesulfonic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 9,10-dioxoanthracene-2-sulfonate Traditional Name: 9,10-diketoanthracene-2-sulfonic acid o-tolyl ester Formula: C21H14O5S MolecularWeight: 378.39786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H14O5S/c1-13-6-2-5-9-19(13)26-27(24,25)14-10-11-17-18(12-14)21(23)16-8-4-3-7-15(16)20(17)22/h2-12H,1H3