5-[chloranyl-bis(fluoranyl)methyl]-3-(3-methoxy-4-nitro-phenoxy)-1-methyl-pyrazole

Systemtic Name: 5-[chloranyl-bis(fluoranyl)methyl]-3-(3-methoxy-4-nitro-phenoxy)-1-methyl-pyrazole Openeye Name: 5-[chloro(difluoro)methyl]-3-(3-methoxy-4-nitro-phenoxy)-1-methyl-pyrazole CAS Name: 5-[chloro(difluoro)methyl]-3-(3-methoxy-4-nitrophenoxy)-1-methylpyrazole IUPAC Name: 5-[chloro(difluoro)methyl]-3-(3-methoxy-4-nitrophenoxy)-1-methylpyrazole Traditional Name: 5-[chloro(difluoro)methyl]-3-(3-methoxy-4-nitro-phenoxy)-1-methyl-pyrazole Formula: C12H10ClF2N3O4 MolecularWeight: 333.675306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)OC2=CC(=C(C=C2)[N+](=O)[O-])OC)C(F)(F)Cl

Isomeric SMILES

CN1C(=CC(=N1)OC2=CC(=C(C=C2)[N+](=O)[O-])OC)C(F)(F)Cl

InChI

InChI=1S/C12H10ClF2N3O4/c1-17-10(12(13,14)15)6-11(16-17)22-7-3-4-8(18(19)20)9(5-7)21-2/h3-6H,1-2H3