sodium 3-bromanyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: sodium 3-bromanyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: sodium 3-bromo-2-hydroxy-cyclohepta-2,4,6-trien-1-one CAS Name: sodium 3-bromo-2-hydroxy-1-cyclohepta-2,4,6-trienone IUPAC Name: sodium 3-bromo-2-hydroxycyclohepta-2,4,6-trien-1-one Traditional Name: sodium 3-bromo-2-hydroxy-cyclohepta-2,4,6-trien-1-one Formula: C7H5BrNaO2+ MolecularWeight: 224.00717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=O)C=C1)O)Br.[Na+]

Isomeric SMILES

C1=CC(=C(C(=O)C=C1)O)Br.[Na+]

InChI

InChI=1S/C7H5BrO2.Na/c8-5-3-1-2-4-6(9)7(5)10;/h1-4H,(H,9,10);/q;+1