ethyl-[3-(2-methyl-4-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-9-yl)oxy-2-oxidanyl-propyl]-(phenylmethyl)azanium chloride

Systemtic Name: ethyl-[3-(2-methyl-4-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-9-yl)oxy-2-oxidanyl-propyl]-(phenylmethyl)azanium chloride Openeye Name: benzyl-ethyl-[2-hydroxy-3-(4-hydroxy-2-methyl-5-oxo-furo[3,2-g]chromen-9-yl)oxy-propyl]ammonium chloride CAS Name: ethyl-[2-hydroxy-3-[(4-hydroxy-2-methyl-5-oxo-9-furo[3,2-g][1]benzopyranyl)oxy]propyl]-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-ethyl-[2-hydroxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropyl]azanium chloride Traditional Name: benzyl-ethyl-[2-hydroxy-3-(4-hydroxy-5-keto-2-methyl-furo[3,2-g]chromen-9-yl)oxy-propyl]ammonium chloride Formula: C24H26ClNO6 MolecularWeight: 459.91934

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(COC2=C3C(=C(C4=C2OC(=C4)C)O)C(=O)C=CO3)O.[Cl-]

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(COC2=C3C(=C(C4=C2OC(=C4)C)O)C(=O)C=CO3)O.[Cl-]

InChI

InChI=1S/C24H25NO6.ClH/c1-3-25(12-16-7-5-4-6-8-16)13-17(26)14-30-24-22-18(11-15(2)31-22)21(28)20-19(27)9-10-29-23(20)24;/h4-11,17,26,28H,3,12-14H2,1-2H3;1H