3-[4-(3-azanylidene-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-ylidene)cyclohexa-2,5-dien-1-ylidene]-1,4-bis(oxidanyl)quinoxalin-2-imine

Systemtic Name: 3-[4-(3-azanylidene-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-ylidene)cyclohexa-2,5-dien-1-ylidene]-1,4-bis(oxidanyl)quinoxalin-2-imine Openeye Name: 1,4-dihydroxy-3-[4-(3-imino-1-oxido-4-oxo-quinoxalin-4-ium-2-ylidene)cyclohexa-2,5-dien-1-ylidene]quinoxalin-2-imine CAS Name: 1,4-dihydroxy-3-[4-(3-imino-1-oxido-4-oxo-2-quinoxalin-4-iumylidene)-1-cyclohexa-2,5-dienylidene]-2-quinoxalinimine IUPAC Name: 1,4-dihydroxy-3-[4-(3-imino-1-oxido-4-oxoquinoxalin-4-ium-2-ylidene)cyclohexa-2,5-dien-1-ylidene]quinoxalin-2-imine Traditional Name: [1,4-dihydroxy-3-[4-(3-imino-4-keto-1-oxido-quinoxalin-4-ium-2-ylidene)cyclohexa-2,5-dien-1-ylidene]quinoxalin-2-ylidene]amine Formula: C22H16N6O4 MolecularWeight: 428.40024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=C3C=CC(=C4C(=N)[N+](=O)C5=CC=CC=C5N4[O-])C=C3)C(=N)N2O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=C3C=CC(=C4C(=N)[N+](=O)C5=CC=CC=C5N4[O-])C=C3)C(=N)N2O)O

InChI

InChI=1S/C22H16N6O4/c23-21-19(25(29)15-5-1-3-7-17(15)27(21)31)13-9-11-14(12-10-13)20-22(24)28(32)18-8-4-2-6-16(18)26(20)30/h1-12,23-24,29,31H