N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[(4-bromo-2-ethyl-3-pyrazolyl)methyl]-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(4-bromo-2-ethylpyrazol-3-yl)methyl]-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C14H19BrN6O3 MolecularWeight: 399.24306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=C(C=NN1CC)Br)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NCC1=C(C=NN1CC)Br)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C14H19BrN6O3/c1-4-11(20-9(3)6-13(18-20)21(23)24)14(22)16-8-12-10(15)7-17-19(12)5-2/h6-7,11H,4-5,8H2,1-3H3,(H,16,22)