(6-chloranyl-7-oxidanyl-2-oxidanylidene-4-phenyl-chromen-8-yl)methyl-(2-oxidanylpropyl)azanium chloride

Systemtic Name: (6-chloranyl-7-oxidanyl-2-oxidanylidene-4-phenyl-chromen-8-yl)methyl-(2-oxidanylpropyl)azanium chloride Openeye Name: (6-chloro-7-hydroxy-2-oxo-4-phenyl-chromen-8-yl)methyl-(2-hydroxypropyl)ammonium chloride CAS Name: (6-chloro-7-hydroxy-2-oxo-4-phenyl-1-benzopyran-8-yl)methyl-(2-hydroxypropyl)ammonium chloride IUPAC Name: (6-chloro-7-hydroxy-2-oxo-4-phenylchromen-8-yl)methyl-(2-hydroxypropyl)azanium chloride Traditional Name: (6-chloro-7-hydroxy-2-keto-4-phenyl-chromen-8-yl)methyl-(2-hydroxypropyl)ammonium chloride Formula: C19H19Cl2NO4 MolecularWeight: 396.26446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1=C2C(=CC(=C1O)Cl)C(=CC(=O)O2)C3=CC=CC=C3)O.[Cl-]

Isomeric SMILES

CC(C[NH2+]CC1=C2C(=CC(=C1O)Cl)C(=CC(=O)O2)C3=CC=CC=C3)O.[Cl-]

InChI

InChI=1S/C19H18ClNO4.ClH/c1-11(22)9-21-10-15-18(24)16(20)7-14-13(8-17(23)25-19(14)15)12-5-3-2-4-6-12;/h2-8,11,21-22,24H,9-10H2,1H3;1H