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

Systemtic Name: 3-bromanyl-2-[(4-methoxyphenyl)methyl]-1-oxidanidyl-pyrazol-1-ium Openeye Name: 3-bromo-2-[(4-methoxyphenyl)methyl]-1-oxido-pyrazol-1-ium CAS Name: 3-bromo-2-[(4-methoxyphenyl)methyl]-1-oxidopyrazol-1-ium IUPAC Name: 3-bromo-2-[(4-methoxyphenyl)methyl]-1-oxidopyrazol-1-ium Traditional Name: 3-bromo-1-oxido-2-p-anisyl-pyrazol-1-ium Formula: C11H11BrN2O2 MolecularWeight: 283.12124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrN2O2/c1-16-10-4-2-9(3-5-10)8-13-11(12)6-7-14(13)15/h2-7H,8H2,1H3