6-chloranyl-1-oxidanyl-3-[(2R)-3-oxidanylidenebutan-2-yl]oxy-xanthen-9-one

Systemtic Name: 6-chloranyl-1-oxidanyl-3-[(2R)-3-oxidanylidenebutan-2-yl]oxy-xanthen-9-one Openeye Name: 6-chloro-1-hydroxy-3-[(1R)-1-methyl-2-oxo-propoxy]xanthen-9-one CAS Name: 6-chloro-1-hydroxy-3-[(2R)-3-oxobutan-2-yl]oxy-9-xanthenone IUPAC Name: 6-chloro-1-hydroxy-3-[(2R)-3-oxobutan-2-yl]oxyxanthen-9-one Traditional Name: 6-chloro-1-hydroxy-3-[(1R)-2-keto-1-methyl-propoxy]xanthone Formula: C17H13ClO5 MolecularWeight: 332.73512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3)Cl)O

Isomeric SMILES

C[C@H](C(=O)C)OC1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3)Cl)O

InChI

InChI=1S/C17H13ClO5/c1-8(19)9(2)22-11-6-13(20)16-15(7-11)23-14-5-10(18)3-4-12(14)17(16)21/h3-7,9,20H,1-2H3/t9-/m1/s1