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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCCCN2C=C(C=N2)Br)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCCCN2C=C(C=N2)Br)C)[N+](=O)[O-]

InChI

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