4-bromanyl-3-[2-(1-hydroxyethyl)phenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 4-bromanyl-3-[2-(1-hydroxyethyl)phenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-bromo-3-[2-(1-hydroxyethyl)phenyl]oxadiazol-3-ium-5-olate CAS Name: 4-bromo-3-[2-(1-hydroxyethyl)phenyl]-5-oxadiazol-3-iumolate IUPAC Name: 4-bromo-3-[2-(1-hydroxyethyl)phenyl]oxadiazol-3-ium-5-olate Traditional Name: 4-bromo-3-[2-(1-hydroxyethyl)phenyl]oxadiazol-3-ium-5-olate Formula: C10H9BrN2O3 MolecularWeight: 285.09406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1[N+]2=NOC(=C2Br)[O-])O

Isomeric SMILES

CC(C1=CC=CC=C1[N+]2=NOC(=C2Br)[O-])O

InChI

InChI=1S/C10H9BrN2O3/c1-6(14)7-4-2-3-5-8(7)13-9(11)10(15)16-12-13/h2-6,14H,1H3