[(2S)-1-[butyl(methyl)amino]-1-oxidanylidene-propan-2-yl]-(3-methylphenyl)azanium

Systemtic Name: [(2S)-1-[butyl(methyl)amino]-1-oxidanylidene-propan-2-yl]-(3-methylphenyl)azanium Openeye Name: [(1S)-2-[butyl(methyl)amino]-1-methyl-2-oxo-ethyl]-(m-tolyl)ammonium CAS Name: [(2S)-1-[butyl(methyl)amino]-1-oxopropan-2-yl]-(3-methylphenyl)ammonium IUPAC Name: [(2S)-1-[butyl(methyl)amino]-1-oxopropan-2-yl]-(3-methylphenyl)azanium Traditional Name: [(1S)-2-[butyl(methyl)amino]-2-keto-1-methyl-ethyl]-(m-tolyl)ammonium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C(C)[NH2+]C1=CC=CC(=C1)C

Isomeric SMILES

CCCCN(C)C(=O)[C@H](C)[NH2+]C1=CC=CC(=C1)C

InChI

InChI=1S/C15H24N2O/c1-5-6-10-17(4)15(18)13(3)16-14-9-7-8-12(2)11-14/h7-9,11,13,16H,5-6,10H2,1-4H3/p+1/t13-/m0/s1