3-(1,3-benzodioxol-5-yl)-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide Formula: C24H17ClN4O6 MolecularWeight: 492.86798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17ClN4O6/c1-13-6-17(3-4-19(13)25)35-18-9-15(8-16(10-18)29(31)32)26-24(30)21-11-20(27-28-21)14-2-5-22-23(7-14)34-12-33-22/h2-11H,12H2,1H3,(H,26,30)(H,27,28)