[(1S)-1-[5-(7-bromanyl-1H-indol-3-yl)-4-methoxycarbonyl-1,3-oxazol-2-yl]-2-methyl-propyl]azanium bromide

Systemtic Name: [(1S)-1-[5-(7-bromanyl-1H-indol-3-yl)-4-methoxycarbonyl-1,3-oxazol-2-yl]-2-methyl-propyl]azanium bromide Openeye Name: [(1S)-1-[5-(7-bromo-1H-indol-3-yl)-4-methoxycarbonyl-oxazol-2-yl]-2-methyl-propyl]ammonium bromide CAS Name: [(1S)-1-[5-(7-bromo-1H-indol-3-yl)-4-methoxycarbonyl-2-oxazolyl]-2-methylpropyl]ammonium bromide IUPAC Name: [(1S)-1-[5-(7-bromo-1H-indol-3-yl)-4-methoxycarbonyl-1,3-oxazol-2-yl]-2-methylpropyl]azanium bromide Traditional Name: [(1S)-1-[5-(7-bromo-1H-indol-3-yl)-4-carbomethoxy-oxazol-2-yl]-2-methyl-propyl]ammonium bromide Formula: C17H19Br2N3O3 MolecularWeight: 473.15906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC(=C(O1)C2=CNC3=C2C=CC=C3Br)C(=O)OC)[NH3+].[Br-]

Isomeric SMILES

CC(C)[C@@H](C1=NC(=C(O1)C2=CNC3=C2C=CC=C3Br)C(=O)OC)[NH3+].[Br-]

InChI

InChI=1S/C17H18BrN3O3.BrH/c1-8(2)12(19)16-21-14(17(22)23-3)15(24-16)10-7-20-13-9(10)5-4-6-11(13)18;/h4-8,12,20H,19H2,1-3H3;1H/t12-;/m0./s1