3-(1,3-benzodioxol-5-yl)-N-(2-methoxy-4-nitro-phenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(2-methoxy-4-nitro-phenyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(2-methoxy-4-nitro-phenyl)-1H-pyrazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(2-methoxy-4-nitrophenyl)-1H-pyrazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(2-methoxy-4-nitrophenyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(2-methoxy-4-nitro-phenyl)-1H-pyrazole-5-carboxamide Formula: C18H14N4O6 MolecularWeight: 382.32696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC(=NN2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC(=NN2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14N4O6/c1-26-16-7-11(22(24)25)3-4-12(16)19-18(23)14-8-13(20-21-14)10-2-5-15-17(6-10)28-9-27-15/h2-8H,9H2,1H3,(H,19,23)(H,20,21)