3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-methyl-propanamide

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-methyl-propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-methyl-propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-methylpropanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-methylpropanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-methyl-propionamide Formula: C21H20BrClN4O4 MolecularWeight: 507.7649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C)Br

InChI

InChI=1S/C21H20BrClN4O4/c1-12(11-26-14(3)20(22)13(2)25-26)21(28)24-16-8-17(27(29)30)10-19(9-16)31-18-6-4-15(23)5-7-18/h4-10,12H,11H2,1-3H3,(H,24,28)