3,4,5-tris(bromanyl)-1-[(4-methoxyphenyl)methyl]-2-oxidanidyl-pyrazol-2-ium

Systemtic Name: 3,4,5-tris(bromanyl)-1-[(4-methoxyphenyl)methyl]-2-oxidanidyl-pyrazol-2-ium Openeye Name: 3,4,5-tribromo-1-[(4-methoxyphenyl)methyl]-2-oxido-pyrazol-2-ium CAS Name: 3,4,5-tribromo-1-[(4-methoxyphenyl)methyl]-2-oxidopyrazol-2-ium IUPAC Name: 3,4,5-tribromo-1-[(4-methoxyphenyl)methyl]-2-oxidopyrazol-2-ium Traditional Name: 3,4,5-tribromo-1-oxido-2-p-anisyl-pyrazol-1-ium Formula: C11H9Br3N2O2 MolecularWeight: 440.91336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(C(=[N+]2[O-])Br)Br)Br

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(C(=[N+]2[O-])Br)Br)Br

InChI

InChI=1S/C11H9Br3N2O2/c1-18-8-4-2-7(3-5-8)6-15-10(13)9(12)11(14)16(15)17/h2-5H,6H2,1H3