9,9-diethyl-2-methyl-10,10-bis(oxidanylidene)-N-(2-oxidanyl-2-phenyl-ethyl)thioxanthene-3-sulfonamide

Systemtic Name: 9,9-diethyl-2-methyl-10,10-bis(oxidanylidene)-N-(2-oxidanyl-2-phenyl-ethyl)thioxanthene-3-sulfonamide Openeye Name: 9,9-diethyl-N-(2-hydroxy-2-phenyl-ethyl)-2-methyl-10,10-dioxo-thioxanthene-3-sulfonamide CAS Name: 9,9-diethyl-N-(2-hydroxy-2-phenylethyl)-2-methyl-10,10-dioxo-3-thioxanthenesulfonamide IUPAC Name: 9,9-diethyl-N-(2-hydroxy-2-phenylethyl)-2-methyl-10,10-dioxothioxanthene-3-sulfonamide Traditional Name: 9,9-diethyl-N-(2-hydroxy-2-phenyl-ethyl)-10,10-diketo-2-methyl-thioxanthene-3-sulfonamide Formula: C26H29NO5S2 MolecularWeight: 499.64216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2S(=O)(=O)C3=CC(=C(C=C31)C)S(=O)(=O)NCC(C4=CC=CC=C4)O)CC

Isomeric SMILES

CCC1(C2=CC=CC=C2S(=O)(=O)C3=CC(=C(C=C31)C)S(=O)(=O)NCC(C4=CC=CC=C4)O)CC

InChI

InChI=1S/C26H29NO5S2/c1-4-26(5-2)20-13-9-10-14-23(20)33(29,30)25-16-24(18(3)15-21(25)26)34(31,32)27-17-22(28)19-11-7-6-8-12-19/h6-16,22,27-28H,4-5,17H2,1-3H3