2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(5-methyl-2-propan-2-yl-phenoxy)-5-nitro-phenyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(5-methyl-2-propan-2-yl-phenoxy)-5-nitro-phenyl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(2-isopropyl-5-methyl-phenoxy)-5-nitro-phenyl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[3-(5-methyl-2-propan-2-ylphenoxy)-5-nitrophenyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[3-(5-methyl-2-propan-2-ylphenoxy)-5-nitrophenyl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(2-isopropyl-5-methyl-phenoxy)-5-nitro-phenyl]acetamide Formula: C22H22BrN5O6 MolecularWeight: 532.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN5O6/c1-12(2)18-6-5-13(3)7-19(18)34-17-9-15(8-16(10-17)27(30)31)24-20(29)11-26-14(4)21(23)22(25-26)28(32)33/h5-10,12H,11H2,1-4H3,(H,24,29)