N-[(4-bromanyl-2-methyl-pyrazol-3-yl)methyl]-N-methyl-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[(4-bromanyl-2-methyl-pyrazol-3-yl)methyl]-N-methyl-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[(4-bromo-2-methyl-pyrazol-3-yl)methyl]-N-methyl-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[(4-bromo-2-methyl-3-pyrazolyl)methyl]-N-methyl-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(4-bromo-2-methylpyrazol-3-yl)methyl]-N-methyl-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[(4-bromo-2-methyl-pyrazol-3-yl)methyl]-N-methyl-2-(4-nitropyrazol-1-yl)butyramide Formula: C13H17BrN6O3 MolecularWeight: 385.21648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C)CC1=C(C=NN1C)Br)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)N(C)CC1=C(C=NN1C)Br)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H17BrN6O3/c1-4-11(19-7-9(5-16-19)20(22)23)13(21)17(2)8-12-10(14)6-15-18(12)3/h5-7,11H,4,8H2,1-3H3