N-[4-chloranyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[4-chloranyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[4-chloro-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[4-chloro-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[4-chloro-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[4-chloro-1-(4-fluorobenzyl)pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H14ClFN6O3 MolecularWeight: 392.772163

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=NN(C=C2Cl)CC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=NN(C=C2Cl)CC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClFN6O3/c1-2-22-9-13(24(26)27)14(20-22)16(25)19-15-12(17)8-23(21-15)7-10-3-5-11(18)6-4-10/h3-6,8-9H,2,7H2,1H3,(H,19,21,25)