2-bromanyl-3-oxidanyl-4-prop-2-enyl-xanthen-9-one

Systemtic Name: 2-bromanyl-3-oxidanyl-4-prop-2-enyl-xanthen-9-one Openeye Name: 4-allyl-2-bromo-3-hydroxy-xanthen-9-one CAS Name: 2-bromo-3-hydroxy-4-prop-2-enyl-9-xanthenone IUPAC Name: 2-bromo-3-hydroxy-4-prop-2-enylxanthen-9-one Traditional Name: 4-allyl-2-bromo-3-hydroxy-xanthone Formula: C16H11BrO3 MolecularWeight: 331.16074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C2C(=CC(=C1O)Br)C(=O)C3=CC=CC=C3O2

Isomeric SMILES

C=CCC1=C2C(=CC(=C1O)Br)C(=O)C3=CC=CC=C3O2

InChI

InChI=1S/C16H11BrO3/c1-2-5-10-15(19)12(17)8-11-14(18)9-6-3-4-7-13(9)20-16(10)11/h2-4,6-8,19H,1,5H2