1,4-bis(4-methyl-4-oxidanidyl-2-oxidanylidene-piperazin-4-ium-1-yl)-5,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1,4-bis(4-methyl-4-oxidanidyl-2-oxidanylidene-piperazin-4-ium-1-yl)-5,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1,4-dihydroxy-5,8-bis(4-methyl-4-oxido-2-oxo-piperazin-4-ium-1-yl)anthracene-9,10-dione CAS Name: 1,4-dihydroxy-5,8-bis(4-methyl-4-oxido-2-oxo-1-piperazin-4-iumyl)anthracene-9,10-dione IUPAC Name: 1,4-dihydroxy-5,8-bis(4-methyl-4-oxido-2-oxopiperazin-4-ium-1-yl)anthracene-9,10-dione Traditional Name: 1,4-dihydroxy-5,8-bis(2-keto-4-methyl-4-oxido-piperazin-4-ium-1-yl)-9,10-anthraquinone Formula: C24H24N4O8 MolecularWeight: 496.46936

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(C(=O)C1)C2=C3C(=C(C=C2)N4CC[N+](CC4=O)(C)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)[O-]

Isomeric SMILES

C[N+]1(CCN(C(=O)C1)C2=C3C(=C(C=C2)N4CC[N+](CC4=O)(C)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)[O-]

InChI

InChI=1S/C24H24N4O8/c1-27(35)9-7-25(17(31)11-27)13-3-4-14(26-8-10-28(2,36)12-18(26)32)20-19(13)23(33)21-15(29)5-6-16(30)22(21)24(20)34/h3-6,29-30H,7-12H2,1-2H3