2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(4-nitro-2-oxidanyl-phenyl)propanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(4-nitro-2-oxidanyl-phenyl)propanamide Openeye Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-(2-hydroxy-4-nitro-phenyl)propanamide CAS Name: 2-(4-bromo-5-methyl-1-pyrazolyl)-N-(2-hydroxy-4-nitrophenyl)propanamide IUPAC Name: 2-(4-bromo-5-methylpyrazol-1-yl)-N-(2-hydroxy-4-nitrophenyl)propanamide Traditional Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-(2-hydroxy-4-nitro-phenyl)propionamide Formula: C13H13BrN4O4 MolecularWeight: 369.17072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)Br

Isomeric SMILES

CC1=C(C=NN1C(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)Br

InChI

InChI=1S/C13H13BrN4O4/c1-7-10(14)6-15-17(7)8(2)13(20)16-11-4-3-9(18(21)22)5-12(11)19/h3-6,8,19H,1-2H3,(H,16,20)