N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-N-piperonyl-pyrazole-3-carboxamide Formula: C25H20N4O6 MolecularWeight: 472.4495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O6/c1-33-20-9-3-17(4-10-20)21-13-22(28(27-21)18-5-7-19(8-6-18)29(31)32)25(30)26-14-16-2-11-23-24(12-16)35-15-34-23/h2-13H,14-15H2,1H3,(H,26,30)