N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C13H12N4O6 MolecularWeight: 320.25758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C13H12N4O6/c1-21-13-11(17(19)20)10(15-16-13)12(18)14-7-2-3-8-9(6-7)23-5-4-22-8/h2-3,6H,4-5H2,1H3,(H,14,18)(H,15,16)