3-bromanyl-2-(5-bromanylfuran-2-yl)-8-chloranyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium

Systemtic Name: 3-bromanyl-2-(5-bromanylfuran-2-yl)-8-chloranyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 3-bromo-2-(5-bromo-2-furyl)-8-chloro-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 3-bromo-2-(5-bromo-2-furanyl)-8-chloro-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 3-bromo-2-(5-bromofuran-2-yl)-8-chloro-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 3-bromo-2-(5-bromo-2-furyl)-8-chloro-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C13H5Br2ClN4O2 MolecularWeight: 444.4654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N3C(=C(C(=N3)C4=CC=C(O4)Br)Br)N=[N+]2[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)N3C(=C(C(=N3)C4=CC=C(O4)Br)Br)N=[N+]2[O-]

InChI

InChI=1S/C13H5Br2ClN4O2/c14-10-4-3-9(22-10)12-11(15)13-18-20(21)7-2-1-6(16)5-8(7)19(13)17-12/h1-5H