3-(3,4-dimethoxyphenyl)-7-(2-morpholin-4-ium-4-ylethoxy)chromen-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-7-(2-morpholin-4-ium-4-ylethoxy)chromen-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-7-(2-morpholin-4-ium-4-ylethoxy)chromen-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-7-[2-(4-morpholin-4-iumyl)ethoxy]-1-benzopyran-4-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-7-(2-morpholin-4-ium-4-ylethoxy)chromen-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-7-(2-morpholin-4-ium-4-ylethoxy)chromone Formula: C23H26NO6+ MolecularWeight: 412.45564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC[NH+]4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC[NH+]4CCOCC4)OC

InChI

InChI=1S/C23H25NO6/c1-26-20-6-3-16(13-22(20)27-2)19-15-30-21-14-17(4-5-18(21)23(19)25)29-12-9-24-7-10-28-11-8-24/h3-6,13-15H,7-12H2,1-2H3/p+1