GHS
GHS Classification Search
CID 101523275
CAS Number: 1253641-99-4
IUPAC name: [4-[3-(dihydroxyamino)-4-oxocyclohexa-2,5-dien-1-ylidene]-3-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)-5-oxopyrrol-2-yl]-hydroxyazanium
Molecular formula: C16H11N4O8+
Molecular weight: 387.28
InChI: InChI=1S/C16H10N4O8/c21-11-3-1-7(5-9(11)19(25)26)13-14(16(23)17-15(13)18-24)8-2-4-12(22)10(6-8)20(27)28/h1-6,24,27-28H,(H,17,18,23)/p+1
InChIKey: QATRNFDNNKGMCQ-UHFFFAOYSA-O
SMILES: C1=CC(=O)C(=CC1=C2C(=C3C=CC(=O)C(=C3)[N+](=O)[O-])C(=NC2=O)[NH2+]O)N(O)O
EINECS: -
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