3-iodanyl-5-oxidanidyl-8-propan-2-yloxy-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium

Systemtic Name: 3-iodanyl-5-oxidanidyl-8-propan-2-yloxy-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 3-iodo-8-isopropoxy-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 3-iodo-5-oxido-8-propan-2-yloxypyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 3-iodo-5-oxido-8-propan-2-yloxypyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 3-iodo-8-isopropoxy-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C12H11IN4O2 MolecularWeight: 370.14581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)I)[O-]

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)I)[O-]

InChI

InChI=1S/C12H11IN4O2/c1-7(2)19-8-3-4-10-11(5-8)16-12(15-17(10)18)9(13)6-14-16/h3-7H,1-2H3