5-methyl-2-[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]benzenesulfonic acid

Systemtic Name: 5-methyl-2-[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]benzenesulfonic acid Openeye Name: 2-(4-hydroxy-9,10-dioxo-1-anthryl)-5-methyl-benzenesulfonic acid CAS Name: 2-(4-hydroxy-9,10-dioxo-1-anthracenyl)-5-methylbenzenesulfonic acid IUPAC Name: 2-(4-hydroxy-9,10-dioxoanthracen-1-yl)-5-methylbenzenesulfonic acid Traditional Name: 2-(4-hydroxy-9,10-diketo-1-anthryl)-5-methyl-besylic acid Formula: C21H14O6S MolecularWeight: 394.39726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O

InChI

InChI=1S/C21H14O6S/c1-11-6-7-12(17(10-11)28(25,26)27)13-8-9-16(22)19-18(13)20(23)14-4-2-3-5-15(14)21(19)24/h2-10,22H,1H3,(H,25,26,27)