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

Systemtic Name: N-[2-[bis(fluoranyl)methoxy]-4-methyl-phenyl]-4-chloranyl-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-N-[2-(difluoromethoxy)-4-methyl-phenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-N-[2-(difluoromethoxy)-4-methylphenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-N-[2-(difluoromethoxy)-4-methylphenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-N-[2-(difluoromethoxy)-4-methyl-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H9ClF2N4O4 MolecularWeight: 346.674066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl)OC(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl)OC(F)F

InChI

InChI=1S/C12H9ClF2N4O4/c1-5-2-3-6(7(4-5)23-12(14)15)16-11(20)9-8(13)10(18-17-9)19(21)22/h2-4,12H,1H3,(H,16,20)(H,17,18)