[1,10-bis[(4-methyl-3-oxidanyl-phenyl)sulfonyloxy]anthracen-2-yl] 4-methyl-3-oxidanyl-benzenesulfonate

Systemtic Name: [1,10-bis[(4-methyl-3-oxidanyl-phenyl)sulfonyloxy]anthracen-2-yl] 4-methyl-3-oxidanyl-benzenesulfonate Openeye Name: [1,10-bis[(3-hydroxy-4-methyl-phenyl)sulfonyloxy]-2-anthryl] 3-hydroxy-4-methyl-benzenesulfonate CAS Name: 3-hydroxy-4-methylbenzenesulfonic acid [1,10-bis[(3-hydroxy-4-methylphenyl)sulfonyloxy]-2-anthracenyl] ester IUPAC Name: [1,10-bis[(3-hydroxy-4-methylphenyl)sulfonyloxy]anthracen-2-yl] 3-hydroxy-4-methylbenzenesulfonate Traditional Name: 3-hydroxy-4-methyl-benzenesulfonic acid [1,10-bis[(3-hydroxy-4-methyl-phenyl)sulfonyloxy]-2-anthryl] ester Formula: C35H28O12S3 MolecularWeight: 736.78462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C3=CC4=CC=CC=C4C(=C3C=C2)OS(=O)(=O)C5=CC(=C(C=C5)C)O)OS(=O)(=O)C6=CC(=C(C=C6)C)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C3=CC4=CC=CC=C4C(=C3C=C2)OS(=O)(=O)C5=CC(=C(C=C5)C)O)OS(=O)(=O)C6=CC(=C(C=C6)C)O)O

InChI

InChI=1S/C35H28O12S3/c1-20-8-11-24(17-30(20)36)48(39,40)45-33-15-14-28-29(35(33)47-50(43,44)26-13-10-22(3)32(38)19-26)16-23-6-4-5-7-27(23)34(28)46-49(41,42)25-12-9-21(2)31(37)18-25/h4-19,36-38H,1-3H3