[1-[4-(diethylamino)-2-(6-oxidanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxidanylidene-pentan-2-yl] ethanoate

Systemtic Name: [1-[4-(diethylamino)-2-(6-oxidanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxidanylidene-pentan-2-yl] ethanoate Openeye Name: [1-[[4-(diethylamino)-2-(6-oxo-1H-pyridazin-3-yl)phenoxy]methyl]-3-oxo-butyl] acetate CAS Name: acetic acid [1-[4-(diethylamino)-2-(6-oxo-1H-pyridazin-3-yl)phenoxy]-4-oxopentan-2-yl] ester IUPAC Name: [1-[4-(diethylamino)-2-(6-oxo-1H-pyridazin-3-yl)phenoxy]-4-oxopentan-2-yl] acetate Traditional Name: acetic acid [1-[[4-(diethylamino)-2-(6-keto-1H-pyridazin-3-yl)phenoxy]methyl]-3-keto-butyl] ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)OCC(CC(=O)C)OC(=O)C)C2=NNC(=O)C=C2

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)OCC(CC(=O)C)OC(=O)C)C2=NNC(=O)C=C2

InChI

InChI=1S/C21H27N3O5/c1-5-24(6-2)16-7-9-20(18(12-16)19-8-10-21(27)23-22-19)28-13-17(11-14(3)25)29-15(4)26/h7-10,12,17H,5-6,11,13H2,1-4H3,(H,23,27)