tert-butyl N-[1-(2-fluoranyl-4-nitro-phenyl)pyrazol-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-(2-fluoranyl-4-nitro-phenyl)pyrazol-3-yl]carbamate Openeye Name: tert-butyl N-[1-(2-fluoro-4-nitro-phenyl)pyrazol-3-yl]carbamate CAS Name: N-[1-(2-fluoro-4-nitrophenyl)-3-pyrazolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(2-fluoro-4-nitrophenyl)pyrazol-3-yl]carbamate Traditional Name: N-[1-(2-fluoro-4-nitro-phenyl)pyrazol-3-yl]carbamic acid tert-butyl ester Formula: C14H15FN4O4 MolecularWeight: 322.291703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NN(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NN(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C14H15FN4O4/c1-14(2,3)23-13(20)16-12-6-7-18(17-12)11-5-4-9(19(21)22)8-10(11)15/h4-8H,1-3H3,(H,16,17,20)