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

Systemtic Name: N-(4-acetamidophenyl)-2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetamide CAS Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)acetamide Traditional Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetamide Formula: C14H14BrN5O4 MolecularWeight: 396.19606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-])Br

InChI

InChI=1S/C14H14BrN5O4/c1-8-13(15)14(20(23)24)18-19(8)7-12(22)17-11-5-3-10(4-6-11)16-9(2)21/h3-6H,7H2,1-2H3,(H,16,21)(H,17,22)