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

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-(2-cyanoethyl)azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-(2-cyanoethyl)ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-(2-cyanoethyl)ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-(2-cyanoethyl)azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-(2-cyanoethyl)ammonium Formula: C13H14BrN2O+ MolecularWeight: 294.16706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CCC#N

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN2O/c1-9(16-6-2-5-15)13-8-10-7-11(14)3-4-12(10)17-13/h3-4,7-9,16H,2,6H2,1H3/p+1/t9-/m0/s1