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

Systemtic Name: N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(4-bromophenoxy)methyl]-4-pyrazolyl]-1,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-1,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H15BrN6O4 MolecularWeight: 435.2321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=CN(N=C2)COC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=CN(N=C2)COC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrN6O4/c1-10-15(23(25)26)14(20-21(10)2)16(24)19-12-7-18-22(8-12)9-27-13-5-3-11(17)4-6-13/h3-8H,9H2,1-2H3,(H,19,24)