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

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl)-[(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-bromo-2,6-dimethyl-phenyl)-[(1S)-2-(dimethylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: (4-bromo-2,6-dimethylphenyl)-[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (4-bromo-2,6-dimethylphenyl)-[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]azanium Traditional Name: (4-bromo-2,6-dimethyl-phenyl)-[(1S)-2-(dimethylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C13H20BrN2O+ MolecularWeight: 300.2147

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[NH2+]C(C)C(=O)N(C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1[NH2+][C@@H](C)C(=O)N(C)C)C)Br

InChI

InChI=1S/C13H19BrN2O/c1-8-6-11(14)7-9(2)12(8)15-10(3)13(17)16(4)5/h6-7,10,15H,1-5H3/p+1/t10-/m0/s1