6-[[2,2-bis(methoxymethyl)-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]oxy]-2-methyl-pyridazin-3-one

Systemtic Name: 6-[[2,2-bis(methoxymethyl)-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]oxy]-2-methyl-pyridazin-3-one Openeye Name: 6-[3-hydroxy-2,2-bis(methoxymethyl)-6-nitro-chroman-4-yl]oxy-2-methyl-pyridazin-3-one CAS Name: 6-[[3-hydroxy-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]oxy]-2-methyl-3-pyridazinone IUPAC Name: 6-[[3-hydroxy-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydrochromen-4-yl]oxy]-2-methylpyridazin-3-one Traditional Name: 6-[3-hydroxy-2,2-bis(methoxymethyl)-6-nitro-chroman-4-yl]oxy-2-methyl-pyridazin-3-one Formula: C18H21N3O8 MolecularWeight: 407.37464

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)OC2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(COC)COC)O

Isomeric SMILES

CN1C(=O)C=CC(=N1)OC2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(COC)COC)O

InChI

InChI=1S/C18H21N3O8/c1-20-15(22)7-6-14(19-20)28-16-12-8-11(21(24)25)4-5-13(12)29-18(9-26-2,10-27-3)17(16)23/h4-8,16-17,23H,9-10H2,1-3H3