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

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-1-[(4-fluoranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2-chloro-5-nitrophenyl)-1-[(4-fluorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide Formula: C17H12ClFN4O4 MolecularWeight: 390.752983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C17H12ClFN4O4/c18-14-6-3-12(23(25)26)9-16(14)20-17(24)15-7-8-22(21-15)10-27-13-4-1-11(19)2-5-13/h1-9H,10H2,(H,20,24)