[6-(4-methylphenyl)sulfonyloxy-5,10-bis(oxidanylidene)benzo[g]phthalazin-9-yl] 4-methylbenzenesulfonate

Systemtic Name: [6-(4-methylphenyl)sulfonyloxy-5,10-bis(oxidanylidene)benzo[g]phthalazin-9-yl] 4-methylbenzenesulfonate Openeye Name: [5,10-dioxo-6-(p-tolylsulfonyloxy)benzo[g]phthalazin-9-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-(4-methylphenyl)sulfonyloxy-5,10-dioxo-9-benzo[g]phthalazinyl] ester IUPAC Name: [6-(4-methylphenyl)sulfonyloxy-5,10-dioxobenzo[g]phthalazin-9-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5,10-diketo-6-tosyloxy-benzo[g]phthalazin-9-yl) ester Formula: C26H18N2O8S2 MolecularWeight: 550.55972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=C(C=C2)OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)C5=CN=NC=C5C3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=C(C=C2)OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)C5=CN=NC=C5C3=O

InChI

InChI=1S/C26H18N2O8S2/c1-15-3-7-17(8-4-15)37(31,32)35-21-11-12-22(36-38(33,34)18-9-5-16(2)6-10-18)24-23(21)25(29)19-13-27-28-14-20(19)26(24)30/h3-14H,1-2H3