N-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C13H17BrN6O3 MolecularWeight: 385.21648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCCCN2C=C(C(=N2)C)Br)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCCCN2C=C(C(=N2)C)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H17BrN6O3/c1-3-18-8-11(20(22)23)12(17-18)13(21)15-5-4-6-19-7-10(14)9(2)16-19/h7-8H,3-6H2,1-2H3,(H,15,21)