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

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[3-nitro-5-(4-oxidanylphenoxy)phenyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[3-(4-hydroxyphenoxy)-5-nitro-phenyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[3-(4-hydroxyphenoxy)-5-nitrophenyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[3-(4-hydroxyphenoxy)-5-nitrophenyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[3-(4-hydroxyphenoxy)-5-nitro-phenyl]acetamide Formula: C19H17N5O7 MolecularWeight: 427.36758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N5O7/c1-11-19(24(29)30)12(2)22(21-11)10-18(26)20-13-7-14(23(27)28)9-17(8-13)31-16-5-3-15(25)4-6-16/h3-9,25H,10H2,1-2H3,(H,20,26)