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

Systemtic Name: 1,4-bis(4-methyl-4-oxidanidyl-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-piperazin-4-ium-1-yl)anthracene-9,10-dione CAS Name: 1,4-dihydroxy-5,8-bis(4-methyl-4-oxido-1-piperazin-4-iumyl)anthracene-9,10-dione IUPAC Name: 1,4-dihydroxy-5,8-bis(4-methyl-4-oxidopiperazin-4-ium-1-yl)anthracene-9,10-dione Traditional Name: 1,4-dihydroxy-5,8-bis(4-methyl-4-oxido-piperazin-4-ium-1-yl)-9,10-anthraquinone Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=C3C(=C(C=C2)N4CC[N+](CC4)(C)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)[O-]

Isomeric SMILES

C[N+]1(CCN(CC1)C2=C3C(=C(C=C2)N4CC[N+](CC4)(C)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)[O-]

InChI

InChI=1S/C24H28N4O6/c1-27(33)11-7-25(8-12-27)15-3-4-16(26-9-13-28(2,34)14-10-26)20-19(15)23(31)21-17(29)5-6-18(30)22(21)24(20)32/h3-6,29-30H,7-14H2,1-2H3