1-tert-butyl-5-chloranyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate

Systemtic Name: 1-tert-butyl-5-chloranyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate Openeye Name: 1-tert-butyl-5-chloro-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate CAS Name: 1-tert-butyl-5-chloro-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate IUPAC Name: 1-tert-butyl-5-chloro-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate Traditional Name: 1-tert-butyl-5-chloro-3-phenyl-anthranil-1-ium tetrafluoroborate Formula: C17H17BClF4NO MolecularWeight: 373.580593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)[N+]1=C2C=CC(=CC2=C(O1)C3=CC=CC=C3)Cl

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)[N+]1=C2C=CC(=CC2=C(O1)C3=CC=CC=C3)Cl

InChI

InChI=1S/C17H17ClNO.BF4/c1-17(2,3)19-15-10-9-13(18)11-14(15)16(20-19)12-7-5-4-6-8-12;2-1(3,4)5/h4-11H,1-3H3;/q+1;-1