2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)acetamide Traditional Name: N-benzyl-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetamide Formula: C13H13BrN4O3 MolecularWeight: 353.17132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCC2=CC=CC=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCC2=CC=CC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H13BrN4O3/c1-9-12(14)13(18(20)21)16-17(9)8-11(19)15-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,15,19)