[2-ethanoyl-4-methyl-6-(6-oxidanylidene-1H-pyridazin-3-yl)-3-propoxy-phenyl] ethanoate; 2-methylpropan-2-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1C(=O)C)OC(=O)C)C2=NNC(=O)C=C2)C.CC(C)(C)N

Isomeric SMILES

CCCOC1=C(C=C(C(=C1C(=O)C)OC(=O)C)C2=NNC(=O)C=C2)C.CC(C)(C)N

InChI

InChI=1S/C18H20N2O5.C4H11N/c1-5-8-24-17-10(2)9-13(14-6-7-15(23)20-19-14)18(25-12(4)22)16(17)11(3)21;1-4(2,3)5/h6-7,9H,5,8H2,1-4H3,(H,20,23);5H2,1-3H3