7-bromanyl-1-oxidanyl-3-(2-oxidanylidenepropoxy)xanthen-9-one

Systemtic Name: 7-bromanyl-1-oxidanyl-3-(2-oxidanylidenepropoxy)xanthen-9-one Openeye Name: 3-acetonyloxy-7-bromo-1-hydroxy-xanthen-9-one CAS Name: 7-bromo-1-hydroxy-3-(2-oxopropoxy)-9-xanthenone IUPAC Name: 7-bromo-1-hydroxy-3-(2-oxopropoxy)xanthen-9-one Traditional Name: 3-acetonyloxy-7-bromo-1-hydroxy-xanthone Formula: C16H11BrO5 MolecularWeight: 363.15954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC(=C2C(=C1)OC3=C(C2=O)C=C(C=C3)Br)O

Isomeric SMILES

CC(=O)COC1=CC(=C2C(=C1)OC3=C(C2=O)C=C(C=C3)Br)O

InChI

InChI=1S/C16H11BrO5/c1-8(18)7-21-10-5-12(19)15-14(6-10)22-13-3-2-9(17)4-11(13)16(15)20/h2-6,19H,7H2,1H3