[1-ethoxy-3-(2-methyl-4-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-9-yl)oxy-propan-2-yl]-diethyl-azanium chloride

Systemtic Name: [1-ethoxy-3-(2-methyl-4-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-9-yl)oxy-propan-2-yl]-diethyl-azanium chloride Openeye Name: [1-(ethoxymethyl)-2-(4-hydroxy-2-methyl-5-oxo-furo[3,2-g]chromen-9-yl)oxy-ethyl]-diethyl-ammonium chloride CAS Name: [1-ethoxy-3-[(4-hydroxy-2-methyl-5-oxo-9-furo[3,2-g][1]benzopyranyl)oxy]propan-2-yl]-diethylammonium chloride IUPAC Name: [1-ethoxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropan-2-yl]-diethylazanium chloride Traditional Name: [1-(ethoxymethyl)-2-(4-hydroxy-5-keto-2-methyl-furo[3,2-g]chromen-9-yl)oxy-ethyl]-diethyl-ammonium chloride Formula: C21H28ClNO6 MolecularWeight: 425.90312

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(COCC)COC1=C2C(=C(C3=C1OC(=C3)C)O)C(=O)C=CO2.[Cl-]

Isomeric SMILES

CC[NH+](CC)C(COCC)COC1=C2C(=C(C3=C1OC(=C3)C)O)C(=O)C=CO2.[Cl-]

InChI

InChI=1S/C21H27NO6.ClH/c1-5-22(6-2)14(11-25-7-3)12-27-21-19-15(10-13(4)28-19)18(24)17-16(23)8-9-26-20(17)21;/h8-10,14,24H,5-7,11-12H2,1-4H3;1H