2-(4-bromanylpyrazol-1-yl)-N-(4-nitro-2-oxidanyl-phenyl)propanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(4-nitro-2-oxidanyl-phenyl)propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(2-hydroxy-4-nitro-phenyl)propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-(2-hydroxy-4-nitrophenyl)propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(2-hydroxy-4-nitrophenyl)propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(2-hydroxy-4-nitro-phenyl)propionamide Formula: C12H11BrN4O4 MolecularWeight: 355.14414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])O)N2C=C(C=N2)Br

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])O)N2C=C(C=N2)Br

InChI

InChI=1S/C12H11BrN4O4/c1-7(16-6-8(13)5-14-16)12(19)15-10-3-2-9(17(20)21)4-11(10)18/h2-7,18H,1H3,(H,15,19)