[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium chloride

Systemtic Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium chloride Openeye Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-2-methyl-4-oxo-chromen-8-yl]methyl-dimethyl-ammonium chloride CAS Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-2-methyl-4-oxo-1-benzopyran-8-yl]methyl-dimethylammonium chloride IUPAC Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-2-methyl-4-oxochromen-8-yl]methyl-dimethylazanium chloride Traditional Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-keto-2-methyl-chromen-8-yl]methyl-dimethyl-ammonium chloride Formula: C23H26ClNO5 MolecularWeight: 431.90924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCO4)C[NH+](C)C)O.[Cl-]

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCO4)C[NH+](C)C)O.[Cl-]

InChI

InChI=1S/C23H25NO5.ClH/c1-5-14-10-16-22(26)20(15-6-7-18-19(11-15)28-9-8-27-18)13(2)29-23(16)17(21(14)25)12-24(3)4;/h6-7,10-11,25H,5,8-9,12H2,1-4H3;1H