N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C13H17BrN6O3 MolecularWeight: 385.21648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)CN2C=C(C=N2)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)CN2C=C(C=N2)[N+](=O)[O-])C)Br

InChI

InChI=1S/C13H17BrN6O3/c1-9-13(14)10(2)19(17-9)5-3-4-15-12(21)8-18-7-11(6-16-18)20(22)23/h6-7H,3-5,8H2,1-2H3,(H,15,21)