3-[3-nitro-4-(oxiran-2-ylmethoxy)phenyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3-nitro-4-(oxiran-2-ylmethoxy)phenyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[3-nitro-4-(oxiran-2-ylmethoxy)phenyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[3-nitro-4-(2-oxiranylmethoxy)phenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[3-nitro-4-(oxiran-2-ylmethoxy)phenyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-(4-glycidoxy-3-nitro-phenyl)-4,5-dihydro-1H-pyridazin-6-one Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC(=C(C=C2)OCC3CO3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)NN=C1C2=CC(=C(C=C2)OCC3CO3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O5/c17-13-4-2-10(14-15-13)8-1-3-12(11(5-8)16(18)19)21-7-9-6-20-9/h1,3,5,9H,2,4,6-7H2,(H,15,17)