[(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(3S)-2-oxidanylideneoxolan-3-yl]azanium

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(3S)-2-oxidanylideneoxolan-3-yl]azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[(3S)-2-oxotetrahydrofuran-3-yl]ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-[(3S)-2-oxo-3-oxolanyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-[(3S)-2-oxooxolan-3-yl]azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[(3S)-2-ketotetrahydrofuran-3-yl]ammonium Formula: C14H15BrNO3+ MolecularWeight: 325.1778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]C3CCOC3=O

Isomeric SMILES

C[C@@H](C1=CC2=C(O1)C=CC(=C2)Br)[NH2+][C@H]3CCOC3=O

InChI

InChI=1S/C14H14BrNO3/c1-8(16-11-4-5-18-14(11)17)13-7-9-6-10(15)2-3-12(9)19-13/h2-3,6-8,11,16H,4-5H2,1H3/p+1/t8-,11-/m0/s1