ethyl 4-(2-acetyloxy-4-oxidanylidene-pentoxy)-3-(6-oxidanylidene-1H-pyridazin-3-yl)benzoate; 2-methylpropan-2-amine

Systemtic Name: ethyl 4-(2-acetyloxy-4-oxidanylidene-pentoxy)-3-(6-oxidanylidene-1H-pyridazin-3-yl)benzoate; 2-methylpropan-2-amine Openeye Name: ethyl 4-(2-acetoxy-4-oxo-pentoxy)-3-(6-oxo-1H-pyridazin-3-yl)benzoate; 2-methylpropan-2-amine CAS Name: 4-(2-acetyloxy-4-oxopentoxy)-3-(6-oxo-1H-pyridazin-3-yl)benzoic acid ethyl ester; 2-methyl-2-propanamine IUPAC Name: ethyl 4-(2-acetyloxy-4-oxopentoxy)-3-(6-oxo-1H-pyridazin-3-yl)benzoate; 2-methylpropan-2-amine Traditional Name: 4-(2-acetoxy-4-keto-pentoxy)-3-(6-keto-1H-pyridazin-3-yl)benzoic acid ethyl ester; tert-butylamine Formula: C24H33N3O7 MolecularWeight: 475.53472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O7.C4H11N/c1-4-27-20(26)14-5-7-18(16(10-14)17-6-8-19(25)22-21-17)28-11-15(9-12(2)23)29-13(3)24;1-4(2,3)5/h5-8,10,15H,4,9,11H2,1-3H3,(H,22,25);5H2,1-3H3