[(2S)-3-methyl-1-(4-methylphenyl)-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-3-methyl-1-(4-methylphenyl)-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-2-methyl-1-(4-methylbenzoyl)propyl]ammonium CAS Name: [(2S)-3-methyl-1-(4-methylphenyl)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-3-methyl-1-(4-methylphenyl)-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-2-methyl-1-p-toluoyl-propyl]ammonium Formula: C12H18NO+ MolecularWeight: 192.27742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C(C)C)[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C(C)C)[NH3+]

InChI

InChI=1S/C12H17NO/c1-8(2)11(13)12(14)10-6-4-9(3)5-7-10/h4-8,11H,13H2,1-3H3/p+1/t11-/m0/s1