N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-1,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-1,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[4-bromo-1-(2,4-dichlorobenzyl)pyrazol-3-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H13BrCl2N6O3 MolecularWeight: 488.12282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=NN(C=C2Br)CC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=NN(C=C2Br)CC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13BrCl2N6O3/c1-8-14(25(27)28)13(21-23(8)2)16(26)20-15-11(17)7-24(22-15)6-9-3-4-10(18)5-12(9)19/h3-5,7H,6H2,1-2H3,(H,20,22,26)