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

Systemtic Name: 5-bromanyl-1-tert-butyl-3-phenyl-2,1-benzoxazol-1-ium Openeye Name: 5-bromo-1-tert-butyl-3-phenyl-2,1-benzoxazol-1-ium CAS Name: 5-bromo-1-tert-butyl-3-phenyl-2,1-benzoxazol-1-ium IUPAC Name: 5-bromo-1-tert-butyl-3-phenyl-2,1-benzoxazol-1-ium Traditional Name: 5-bromo-1-tert-butyl-3-phenyl-anthranil-1-ium Formula: C17H17BrNO+ MolecularWeight: 331.22698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]1=C2C=CC(=CC2=C(O1)C3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(C)[N+]1=C2C=CC(=CC2=C(O1)C3=CC=CC=C3)Br

InChI

InChI=1S/C17H17BrNO/c1-17(2,3)19-15-10-9-13(18)11-14(15)16(20-19)12-7-5-4-6-8-12/h4-11H,1-3H3/q+1