bis[4-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl] sulfate

Systemtic Name: bis[4-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl] sulfate Openeye Name: bis(4-amino-9,10-dioxo-1-anthryl) sulfate CAS Name: sulfuric acid bis(4-amino-9,10-dioxo-1-anthracenyl) ester IUPAC Name: bis(4-amino-9,10-dioxoanthracen-1-yl) sulfate Traditional Name: sulfuric acid bis(4-amino-9,10-diketo-1-anthryl) ester Formula: C28H16N2O8S MolecularWeight: 540.50024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)OS(=O)(=O)OC4=C5C(=C(C=C4)N)C(=O)C6=CC=CC=C6C5=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)OS(=O)(=O)OC4=C5C(=C(C=C4)N)C(=O)C6=CC=CC=C6C5=O)N

InChI

InChI=1S/C28H16N2O8S/c29-17-9-11-19(23-21(17)25(31)13-5-1-3-7-15(13)27(23)33)37-39(35,36)38-20-12-10-18(30)22-24(20)28(34)16-8-4-2-6-14(16)26(22)32/h1-12H,29-30H2