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

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-methylpropanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-methylpropanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-propionamide Formula: C22H22BrClN4O4 MolecularWeight: 521.79148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)CN3C(=C(C(=N3)C)Br)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)CN3C(=C(C(=N3)C)Br)C)Cl

InChI

InChI=1S/C22H22BrClN4O4/c1-12-7-18(5-6-20(12)24)32-19-9-16(8-17(10-19)28(30)31)25-22(29)13(2)11-27-15(4)21(23)14(3)26-27/h5-10,13H,11H2,1-4H3,(H,25,29)