[(1R)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [(1R)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [(1R)-1-(5-bromobenzofuran-2-yl)ethyl]-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [(1R)-1-(5-bromo-2-benzofuranyl)ethyl]-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [(1R)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [(1R)-1-(5-bromobenzofuran-2-yl)ethyl]-[(1R)-1-methylolpropyl]ammonium Formula: C14H19BrNO2+ MolecularWeight: 313.21016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO2/c1-3-12(8-17)16-9(2)14-7-10-6-11(15)4-5-13(10)18-14/h4-7,9,12,16-17H,3,8H2,1-2H3/p+1/t9-,12-/m1/s1