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

Systemtic Name: [(2S)-4-methyl-1-(4-methylphenyl)-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-3-methyl-1-(4-methylbenzoyl)butyl]ammonium CAS Name: [(2S)-4-methyl-1-(4-methylphenyl)-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-4-methyl-1-(4-methylphenyl)-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-3-methyl-1-p-toluoyl-butyl]ammonium Formula: C13H20NO+ MolecularWeight: 206.304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO/c1-9(2)8-12(14)13(15)11-6-4-10(3)5-7-11/h4-7,9,12H,8,14H2,1-3H3/p+1/t12-/m0/s1