3-(3,5-dimethylphenoxy)-7-(3-morpholin-4-yl-2-oxidanyl-propoxy)chromen-4-one hydrochloride

Systemtic Name: 3-(3,5-dimethylphenoxy)-7-(3-morpholin-4-yl-2-oxidanyl-propoxy)chromen-4-one hydrochloride Openeye Name: 3-(3,5-dimethylphenoxy)-7-(2-hydroxy-3-morpholino-propoxy)chromen-4-one hydrochloride CAS Name: 3-(3,5-dimethylphenoxy)-7-[2-hydroxy-3-(4-morpholinyl)propoxy]-1-benzopyran-4-one hydrochloride IUPAC Name: 3-(3,5-dimethylphenoxy)-7-(2-hydroxy-3-morpholin-4-ylpropoxy)chromen-4-one hydrochloride Traditional Name: 3-(3,5-dimethylphenoxy)-7-(2-hydroxy-3-morpholino-propoxy)chromone hydrochloride Formula: C24H28ClNO6 MolecularWeight: 461.93522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC(CN4CCOCC4)O)C.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC(CN4CCOCC4)O)C.Cl

InChI

InChI=1S/C24H27NO6.ClH/c1-16-9-17(2)11-20(10-16)31-23-15-30-22-12-19(3-4-21(22)24(23)27)29-14-18(26)13-25-5-7-28-8-6-25;/h3-4,9-12,15,18,26H,5-8,13-14H2,1-2H3;1H