N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-1-ethyl-3,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-1-ethyl-3,5-dimethylpyrazole-4-carboxamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-3,5-dimethyl-pyrazole-4-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C(=O)NC2=CC(=CC(=C2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C(=O)NC2=CC(=CC(=C2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N4O4/c1-6-25-16(5)21(15(4)24-25)22(27)23-17-10-18(26(28)29)12-20(11-17)30-19-8-13(2)7-14(3)9-19/h7-12H,6H2,1-5H3,(H,23,27)