N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H15BrN6O3 MolecularWeight: 371.1899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)C2=CC(=NN2)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)C2=CC(=NN2)[N+](=O)[O-])C)Br

InChI

InChI=1S/C12H15BrN6O3/c1-7-11(13)8(2)18(17-7)5-3-4-14-12(20)9-6-10(16-15-9)19(21)22/h6H,3-5H2,1-2H3,(H,14,20)(H,15,16)