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

Systemtic Name: tert-butyl-[3-(2-methyl-4-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-9-yl)oxy-2-oxidanyl-propyl]azanium chloride Openeye Name: tert-butyl-[2-hydroxy-3-(4-hydroxy-2-methyl-5-oxo-furo[3,2-g]chromen-9-yl)oxy-propyl]ammonium chloride CAS Name: tert-butyl-[2-hydroxy-3-[(4-hydroxy-2-methyl-5-oxo-9-furo[3,2-g][1]benzopyranyl)oxy]propyl]ammonium chloride IUPAC Name: tert-butyl-[2-hydroxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropyl]azanium chloride Traditional Name: tert-butyl-[2-hydroxy-3-(4-hydroxy-5-keto-2-methyl-furo[3,2-g]chromen-9-yl)oxy-propyl]ammonium chloride Formula: C19H24ClNO6 MolecularWeight: 397.84996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(O1)C(=C3C(=C2O)C(=O)C=CO3)OCC(C[NH2+]C(C)(C)C)O.[Cl-]

Isomeric SMILES

CC1=CC2=C(O1)C(=C3C(=C2O)C(=O)C=CO3)OCC(C[NH2+]C(C)(C)C)O.[Cl-]

InChI

InChI=1S/C19H23NO6.ClH/c1-10-7-12-15(23)14-13(22)5-6-24-17(14)18(16(12)26-10)25-9-11(21)8-20-19(2,3)4;/h5-7,11,20-21,23H,8-9H2,1-4H3;1H