(4-bromanyl-2,6-dimethyl-phenyl)-[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl)-[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-bromo-2,6-dimethyl-phenyl)-[(1S)-2-(diethylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: (4-bromo-2,6-dimethylphenyl)-[(2S)-1-(diethylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (4-bromo-2,6-dimethylphenyl)-[(2S)-1-(diethylamino)-1-oxopropan-2-yl]azanium Traditional Name: (4-bromo-2,6-dimethyl-phenyl)-[(1S)-2-(diethylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C15H24BrN2O+ MolecularWeight: 328.26786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C)[NH2+]C1=C(C=C(C=C1C)Br)C

Isomeric SMILES

CCN(CC)C(=O)[C@H](C)[NH2+]C1=C(C=C(C=C1C)Br)C

InChI

InChI=1S/C15H23BrN2O/c1-6-18(7-2)15(19)12(5)17-14-10(3)8-13(16)9-11(14)4/h8-9,12,17H,6-7H2,1-5H3/p+1/t12-/m0/s1