N-(5-chloranyl-2-oxidanyl-phenyl)-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(5-chloro-2-hydroxy-phenyl)-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-1-[(5-fluoro-2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(5-chloro-2-hydroxyphenyl)-1-[(5-fluoro-2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(5-chloro-2-hydroxy-phenyl)-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C17H12ClFN4O5 MolecularWeight: 406.752383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)OCN2C=CC(=N2)C(=O)NC3=C(C=CC(=C3)Cl)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1F)OCN2C=CC(=N2)C(=O)NC3=C(C=CC(=C3)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C17H12ClFN4O5/c18-10-1-4-15(24)13(7-10)20-17(25)12-5-6-22(21-12)9-28-16-8-11(19)2-3-14(16)23(26)27/h1-8,24H,9H2,(H,20,25)