[(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C14H19BrNO2+ MolecularWeight: 313.21016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO2/c1-9(16-14(2,3)8-17)13-7-10-6-11(15)4-5-12(10)18-13/h4-7,9,16-17H,8H2,1-3H3/p+1/t9-/m0/s1