N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C19H16ClN5O6 MolecularWeight: 445.81324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-])N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-])N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClN5O6/c1-2-18(23-11-15(10-21-23)25(29)30)19(26)22-13-7-14(24(27)28)9-17(8-13)31-16-5-3-12(20)4-6-16/h3-11,18H,2H2,1H3,(H,22,26)