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

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(3,4-dimethylphenyl)propanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(3,4-dimethylphenyl)propanamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(3,4-dimethylphenyl)propanamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(3,4-dimethylphenyl)propanamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(3,4-dimethylphenyl)propionamide Formula: C15H17BrN4O3 MolecularWeight: 381.22448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17BrN4O3/c1-8-5-6-12(7-9(8)2)17-15(21)11(4)19-10(3)13(16)14(18-19)20(22)23/h5-7,11H,1-4H3,(H,17,21)