diethylazanium; 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-oxidanylidene-chromen-7-yl]oxyethanoate

Systemtic Name: diethylazanium; 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-oxidanylidene-chromen-7-yl]oxyethanoate Openeye Name: diethylammonium; 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-oxo-chromen-7-yl]oxyacetate CAS Name: diethylammonium; 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-oxo-1-benzopyran-7-yl]oxy]acetate IUPAC Name: diethylazanium; 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-oxochromen-7-yl]oxyacetate Traditional Name: diethylammonium; 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-keto-chromen-7-yl]oxyacetate Formula: C25H29NO7 MolecularWeight: 455.50026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OCC(=O)[O-].CC[NH2+]CC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OCC(=O)[O-].CC[NH2+]CC

InChI

InChI=1S/C21H18O7.C4H11N/c1-2-12-7-14-18(9-17(12)28-11-20(22)23)27-10-15(21(14)24)13-3-4-16-19(8-13)26-6-5-25-16;1-3-5-4-2/h3-4,7-10H,2,5-6,11H2,1H3,(H,22,23);5H,3-4H2,1-2H3