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

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-ethyl-pyrazol-4-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-1-ethyl-pyrazol-4-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-ethyl-4-pyrazolamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-ethylpyrazol-4-amine Traditional Name: (4-bromo-3-nitro-benzyl)-(1-ethylpyrazol-4-yl)amine Formula: C12H13BrN4O2 MolecularWeight: 325.16122

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C=N1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H13BrN4O2/c1-2-16-8-10(7-15-16)14-6-9-3-4-11(13)12(5-9)17(18)19/h3-5,7-8,14H,2,6H2,1H3