[3-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-6-yl)oxy-2-oxidanyl-propyl]-diethyl-azanium chloride

Systemtic Name: [3-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-6-yl)oxy-2-oxidanyl-propyl]-diethyl-azanium chloride Openeye Name: [3-(7,8-dimethoxy-4-methyl-2-oxo-chromen-6-yl)oxy-2-hydroxy-propyl]-diethyl-ammonium chloride CAS Name: [3-[(7,8-dimethoxy-4-methyl-2-oxo-1-benzopyran-6-yl)oxy]-2-hydroxypropyl]-diethylammonium chloride IUPAC Name: [3-(7,8-dimethoxy-4-methyl-2-oxochromen-6-yl)oxy-2-hydroxypropyl]-diethylazanium chloride Traditional Name: diethyl-[2-hydroxy-3-(2-keto-7,8-dimethoxy-4-methyl-chromen-6-yl)oxy-propyl]ammonium chloride Formula: C19H28ClNO6 MolecularWeight: 401.88172

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(COC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)OC)OC)O.[Cl-]

Isomeric SMILES

CC[NH+](CC)CC(COC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)OC)OC)O.[Cl-]

InChI

InChI=1S/C19H27NO6.ClH/c1-6-20(7-2)10-13(21)11-25-15-9-14-12(3)8-16(22)26-17(14)19(24-5)18(15)23-4;/h8-9,13,21H,6-7,10-11H2,1-5H3;1H