2-(1,3-benzoxazol-2-yl)-1-(3-bromanyl-5-fluoranyl-phenyl)ethanamine

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-1-(3-bromanyl-5-fluoranyl-phenyl)ethanamine Openeye Name: 2-(1,3-benzoxazol-2-yl)-1-(3-bromo-5-fluoro-phenyl)ethanamine CAS Name: 2-(1,3-benzoxazol-2-yl)-1-(3-bromo-5-fluorophenyl)ethanamine IUPAC Name: 2-(1,3-benzoxazol-2-yl)-1-(3-bromo-5-fluorophenyl)ethanamine Traditional Name: [2-(1,3-benzoxazol-2-yl)-1-(3-bromo-5-fluoro-phenyl)ethyl]amine Formula: C15H12BrFN2O MolecularWeight: 335.170983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)CC(C3=CC(=CC(=C3)Br)F)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)CC(C3=CC(=CC(=C3)Br)F)N

InChI

InChI=1S/C15H12BrFN2O/c16-10-5-9(6-11(17)7-10)12(18)8-15-19-13-3-1-2-4-14(13)20-15/h1-7,12H,8,18H2