3-(1,3-benzodioxol-5-yl)-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide Formula: C25H20N4O6 MolecularWeight: 472.4495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H20N4O6/c1-14-3-4-15(2)23(7-14)35-19-10-17(9-18(11-19)29(31)32)26-25(30)21-12-20(27-28-21)16-5-6-22-24(8-16)34-13-33-22/h3-12H,13H2,1-2H3,(H,26,30)(H,27,28)