[(2S)-1-[(5-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S)-1-[(5-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium Openeye Name: [(1S)-2-(5-amino-2-methyl-anilino)-1-methyl-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [(2S)-1-(5-amino-2-methylanilino)-1-oxopropan-2-yl]-dimethylammonium IUPAC Name: [(2S)-1-(5-amino-2-methylanilino)-1-oxopropan-2-yl]-dimethylazanium Traditional Name: [(1S)-2-(5-amino-2-methyl-anilino)-2-keto-1-methyl-ethyl]-dimethyl-ammonium Formula: C12H20N3O+ MolecularWeight: 222.3067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)NC(=O)C(C)[NH+](C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N)NC(=O)[C@H](C)[NH+](C)C

InChI

InChI=1S/C12H19N3O/c1-8-5-6-10(13)7-11(8)14-12(16)9(2)15(3)4/h5-7,9H,13H2,1-4H3,(H,14,16)/p+1/t9-/m0/s1