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

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(2-methyl-4-nitro-phenyl)propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(2-methyl-4-nitro-phenyl)propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-(2-methyl-4-nitrophenyl)propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(2-methyl-4-nitrophenyl)propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C13H13BrN4O3 MolecularWeight: 353.17132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)N2C=C(C=N2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)N2C=C(C=N2)Br

InChI

InChI=1S/C13H13BrN4O3/c1-8-5-11(18(20)21)3-4-12(8)16-13(19)9(2)17-7-10(14)6-15-17/h3-7,9H,1-2H3,(H,16,19)