N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-methyl-pyrazol-4-amine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-methyl-pyrazol-4-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-1-methyl-pyrazol-4-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-methyl-4-pyrazolamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-methylpyrazol-4-amine Traditional Name: (4-bromo-3-nitro-benzyl)-(1-methylpyrazol-4-yl)amine Formula: C11H11BrN4O2 MolecularWeight: 311.13464

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C11H11BrN4O2/c1-15-7-9(6-14-15)13-5-8-2-3-10(12)11(4-8)16(17)18/h2-4,6-7,13H,5H2,1H3