[1-[4-methyl-2-(6-oxidanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxidanylidene-pentan-2-yl] ethanoate; 2-methylpropan-2-amine

Systemtic Name: [1-[4-methyl-2-(6-oxidanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxidanylidene-pentan-2-yl] ethanoate; 2-methylpropan-2-amine Openeye Name: [1-[[4-methyl-2-(6-oxo-1H-pyridazin-3-yl)phenoxy]methyl]-3-oxo-butyl] acetate; 2-methylpropan-2-amine CAS Name: acetic acid [1-[4-methyl-2-(6-oxo-1H-pyridazin-3-yl)phenoxy]-4-oxopentan-2-yl] ester; 2-methyl-2-propanamine IUPAC Name: [1-[4-methyl-2-(6-oxo-1H-pyridazin-3-yl)phenoxy]-4-oxopentan-2-yl] acetate; 2-methylpropan-2-amine Traditional Name: acetic acid [3-keto-1-[[2-(6-keto-1H-pyridazin-3-yl)-4-methyl-phenoxy]methyl]butyl] ester; tert-butylamine Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(CC(=O)C)OC(=O)C)C2=NNC(=O)C=C2.CC(C)(C)N

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(CC(=O)C)OC(=O)C)C2=NNC(=O)C=C2.CC(C)(C)N

InChI

InChI=1S/C18H20N2O5.C4H11N/c1-11-4-6-17(15(8-11)16-5-7-18(23)20-19-16)24-10-14(9-12(2)21)25-13(3)22;1-4(2,3)5/h4-8,14H,9-10H2,1-3H3,(H,20,23);5H2,1-3H3