4-bromanyl-N-(6-methylheptan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-(6-methylheptan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-(1,5-dimethylhexyl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(6-methylheptan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(6-methylheptan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-(1,5-dimethylhexyl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H19BrN4O3 MolecularWeight: 347.20826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C1=C(C(=NN1)[N+](=O)[O-])Br

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C1=C(C(=NN1)[N+](=O)[O-])Br

InChI

InChI=1S/C12H19BrN4O3/c1-7(2)5-4-6-8(3)14-12(18)10-9(13)11(16-15-10)17(19)20/h7-8H,4-6H2,1-3H3,(H,14,18)(H,15,16)