1-(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)-3,5-dimethyl-4-nitro-pyrazole

Systemtic Name: 1-(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-(4-chloro-2-fluoro-5-prop-2-ynoxy-phenyl)-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-(4-chloro-2-fluoro-5-prop-2-ynoxyphenyl)-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-(4-chloro-2-fluoro-5-prop-2-ynoxyphenyl)-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-(4-chloro-2-fluoro-5-propargyloxy-phenyl)-3,5-dimethyl-4-nitro-pyrazole Formula: C14H11ClFN3O3 MolecularWeight: 323.706843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=C(C=C2F)Cl)OCC#C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=C(C=C2F)Cl)OCC#C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClFN3O3/c1-4-5-22-13-7-12(11(16)6-10(13)15)18-9(3)14(19(20)21)8(2)17-18/h1,6-7H,5H2,2-3H3