(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-[(2R)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]azanium chloride

Systemtic Name: (4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-[(2R)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]azanium chloride Openeye Name: [(1R)-1-benzyl-2-hydroxy-2-oxo-ethyl]-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]ammonium chloride CAS Name: (7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl-[(2R)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]ammonium chloride IUPAC Name: (7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl-[(2R)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]azanium chloride Traditional Name: [(1R)-1-benzyl-2-hydroxy-2-keto-ethyl]-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]ammonium chloride Formula: C20H20ClNO5 MolecularWeight: 389.8295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C[NH2+]C(CC3=CC=CC=C3)C(=O)O)O.[Cl-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C[NH2+][C@H](CC3=CC=CC=C3)C(=O)O)O.[Cl-]

InChI

InChI=1S/C20H19NO5.ClH/c1-12-9-18(23)26-19-14(12)7-8-17(22)15(19)11-21-16(20(24)25)10-13-5-3-2-4-6-13;/h2-9,16,21-22H,10-11H2,1H3,(H,24,25);1H/t16-;/m1./s1