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

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[1-[(4-bromophenoxy)methyl]-4-pyrazolyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]acetamide Formula: C16H14Br2N6O4 MolecularWeight: 514.12816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CN(N=C2)COC3=CC=C(C=C3)Br)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CN(N=C2)COC3=CC=C(C=C3)Br)[N+](=O)[O-])Br

InChI

InChI=1S/C16H14Br2N6O4/c1-10-15(18)16(24(26)27)21-23(10)8-14(25)20-12-6-19-22(7-12)9-28-13-4-2-11(17)3-5-13/h2-7H,8-9H2,1H3,(H,20,25)