N-[3-(4-fluoranylphenoxy)-5-nitro-phenyl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[3-(4-fluoranylphenoxy)-5-nitro-phenyl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[3-(4-fluorophenoxy)-5-nitro-phenyl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[3-(4-fluorophenoxy)-5-nitrophenyl]-4-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[3-(4-fluorophenoxy)-5-nitrophenyl]-4-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-[3-(4-fluorophenoxy)-5-nitro-phenyl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C20H18FN5O6 MolecularWeight: 443.385223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCCC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O6/c1-13-9-19(26(30)31)23-24(13)8-2-3-20(27)22-15-10-16(25(28)29)12-18(11-15)32-17-6-4-14(21)5-7-17/h4-7,9-12H,2-3,8H2,1H3,(H,22,27)