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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)-N-piperonyl-pyrazole-3-carboxamide Formula: C26H22N4O7 MolecularWeight: 502.47548

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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-])OC

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-])OC

InChI

InChI=1S/C26H22N4O7/c1-34-19-8-9-20(24(12-19)35-2)21-13-22(29(28-21)17-4-6-18(7-5-17)30(32)33)26(31)27-14-16-3-10-23-25(11-16)37-15-36-23/h3-13H,14-15H2,1-2H3,(H,27,31)