5-(2-bromanyl-4-methyl-phenoxy)-1,3-dimethyl-4-nitro-pyrazole

Systemtic Name: 5-(2-bromanyl-4-methyl-phenoxy)-1,3-dimethyl-4-nitro-pyrazole Openeye Name: 5-(2-bromo-4-methyl-phenoxy)-1,3-dimethyl-4-nitro-pyrazole CAS Name: 5-(2-bromo-4-methylphenoxy)-1,3-dimethyl-4-nitropyrazole IUPAC Name: 5-(2-bromo-4-methylphenoxy)-1,3-dimethyl-4-nitropyrazole Traditional Name: 5-(2-bromo-4-methyl-phenoxy)-1,3-dimethyl-4-nitro-pyrazole Formula: C12H12BrN3O3 MolecularWeight: 326.14598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C(=NN2C)C)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C(=NN2C)C)[N+](=O)[O-])Br

InChI

InChI=1S/C12H12BrN3O3/c1-7-4-5-10(9(13)6-7)19-12-11(16(17)18)8(2)14-15(12)3/h4-6H,1-3H3