N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

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