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

Systemtic Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-4-oxidanylidene-chromen-7-yl]oxyethanoate; morpholin-4-ium Openeye Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-4-oxo-chromen-7-yl]oxyacetate; morpholin-4-ium CAS Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-4-oxo-1-benzopyran-7-yl]oxy]acetate; morpholin-4-ium IUPAC Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-4-oxochromen-7-yl]oxyacetate; morpholin-4-ium Traditional Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-4-keto-chromen-7-yl]oxyacetate; morpholin-4-ium Formula: C25H27NO8 MolecularWeight: 469.48378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)[O-])C3=CC4=C(C=C3)OCCO4.C1COCC[NH2+]1

Isomeric SMILES

CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)[O-])C3=CC4=C(C=C3)OCCO4.C1COCC[NH2+]1

InChI

InChI=1S/C21H18O7.C4H9NO/c1-2-15-20(12-3-6-16-18(9-12)26-8-7-25-16)21(24)14-5-4-13(10-17(14)28-15)27-11-19(22)23;1-3-6-4-2-5-1/h3-6,9-10H,2,7-8,11H2,1H3,(H,22,23);5H,1-4H2