N-(4-chloranyl-2-nitro-phenyl)-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-chloro-2-nitrophenyl)-1-[(5-fluoro-2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-1-[(5-fluoro-2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C17H11ClFN5O6 MolecularWeight: 435.750543

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=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClFN5O6/c18-10-1-3-12(15(7-10)24(28)29)20-17(25)13-5-6-22(21-13)9-30-16-8-11(19)2-4-14(16)23(26)27/h1-8H,9H2,(H,20,25)