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

Systemtic Name: 6-[[2-(methoxymethyl)-2-methyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]oxy]-2-methyl-pyridazin-3-one Openeye Name: 6-[3-hydroxy-2-(methoxymethyl)-2-methyl-6-nitro-chroman-4-yl]oxy-2-methyl-pyridazin-3-one CAS Name: 6-[[3-hydroxy-2-(methoxymethyl)-2-methyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]oxy]-2-methyl-3-pyridazinone IUPAC Name: 6-[[3-hydroxy-2-(methoxymethyl)-2-methyl-6-nitro-3,4-dihydrochromen-4-yl]oxy]-2-methylpyridazin-3-one Traditional Name: 6-[3-hydroxy-2-(methoxymethyl)-2-methyl-6-nitro-chroman-4-yl]oxy-2-methyl-pyridazin-3-one Formula: C17H19N3O7 MolecularWeight: 377.34866

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])OC3=NN(C(=O)C=C3)C)O)COC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])OC3=NN(C(=O)C=C3)C)O)COC

InChI

InChI=1S/C17H19N3O7/c1-17(9-25-3)16(22)15(26-13-6-7-14(21)19(2)18-13)11-8-10(20(23)24)4-5-12(11)27-17/h4-8,15-16,22H,9H2,1-3H3