4-bromanyl-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-ethyl-pyrazole-3-carboxamide Formula: C18H14BrClN4O4 MolecularWeight: 465.68516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H14BrClN4O4/c1-2-23-17(16(19)10-21-23)18(25)22-12-7-13(24(26)27)9-15(8-12)28-14-5-3-11(20)4-6-14/h3-10H,2H2,1H3,(H,22,25)