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

Systemtic Name: N-(4-acetamidophenyl)-2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-acetamidophenyl)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C15H16BrN5O4 MolecularWeight: 410.22264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16BrN5O4/c1-8-13(16)14(21(24)25)19-20(8)9(2)15(23)18-12-6-4-11(5-7-12)17-10(3)22/h4-7,9H,1-3H3,(H,17,22)(H,18,23)