2-(3-ethoxy-4-nitro-pyrazol-1-yl)-4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidine

Systemtic Name: 2-(3-ethoxy-4-nitro-pyrazol-1-yl)-4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidine Openeye Name: 2-(3-ethoxy-4-nitro-pyrazol-1-yl)-4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidine CAS Name: 2-(3-ethoxy-4-nitro-1-pyrazolyl)-4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidine IUPAC Name: 2-(3-ethoxy-4-nitropyrazol-1-yl)-4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidine Traditional Name: 2-(3-ethoxy-4-nitro-pyrazol-1-yl)-4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidine Formula: C16H11F4N5O3 MolecularWeight: 397.283853

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C=C1[N+](=O)[O-])C2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=NN(C=C1[N+](=O)[O-])C2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H11F4N5O3/c1-2-28-14-12(25(26)27)8-24(23-14)15-21-11(7-13(22-15)16(18,19)20)9-3-5-10(17)6-4-9/h3-8H,2H2,1H3