5-bromanyl-1-tert-butyl-6-ethyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate

Systemtic Name: 5-bromanyl-1-tert-butyl-6-ethyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate Openeye Name: 5-bromo-1-tert-butyl-6-ethyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate CAS Name: 5-bromo-1-tert-butyl-6-ethyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate IUPAC Name: 5-bromo-1-tert-butyl-6-ethyl-3-phenyl-2,1-benzoxazol-1-ium tetrafluoroborate Traditional Name: 5-bromo-1-tert-butyl-6-ethyl-3-phenyl-anthranil-1-ium tetrafluoroborate Formula: C19H21BBrF4NO MolecularWeight: 446.084753

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCC1=CC2=[N+](OC(=C2C=C1Br)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

[B-](F)(F)(F)F.CCC1=CC2=[N+](OC(=C2C=C1Br)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C19H21BrNO.BF4/c1-5-13-11-17-15(12-16(13)20)18(14-9-7-6-8-10-14)22-21(17)19(2,3)4;2-1(3,4)5/h6-12H,5H2,1-4H3;/q+1;-1