3-iodanyl-7-methoxy-6-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium

Systemtic Name: 3-iodanyl-7-methoxy-6-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium Openeye Name: 3-iodo-7-methoxy-6-methyl-1-oxido-1,2,4-benzotriazin-1-ium CAS Name: 3-iodo-7-methoxy-6-methyl-1-oxido-1,2,4-benzotriazin-1-ium IUPAC Name: 3-iodo-7-methoxy-6-methyl-1-oxido-1,2,4-benzotriazin-1-ium Traditional Name: 3-iodo-7-methoxy-6-methyl-1-oxido-1,2,4-benzotriazin-1-ium Formula: C9H8IN3O2 MolecularWeight: 317.08319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1OC)[N+](=NC(=N2)I)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1OC)[N+](=NC(=N2)I)[O-]

InChI

InChI=1S/C9H8IN3O2/c1-5-3-6-7(4-8(5)15-2)13(14)12-9(10)11-6/h3-4H,1-2H3