N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-chloranyl-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-chloranyl-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide Formula: C16H14BrClN6O3 MolecularWeight: 453.67776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl)C)Br

InChI

InChI=1S/C16H14BrClN6O3/c1-8-12(17)9(2)23(22-8)7-10-4-3-5-11(6-10)19-16(25)14-13(18)15(21-20-14)24(26)27/h3-6H,7H2,1-2H3,(H,19,25)(H,20,21)