[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(4-ethylphenyl)-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(4-ethylbenzoyl)propyl]ammonium CAS Name: [(2S)-1-(4-ethylphenyl)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-ethylphenyl)-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(4-ethylbenzoyl)propyl]ammonium Formula: C12H18NO+ MolecularWeight: 192.27742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(CC)[NH3+]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](CC)[NH3+]

InChI

InChI=1S/C12H17NO/c1-3-9-5-7-10(8-6-9)12(14)11(13)4-2/h5-8,11H,3-4,13H2,1-2H3/p+1/t11-/m0/s1