[(1S)-1-(2,3-dimethylphenyl)-3-ethoxy-3-oxidanylidene-propyl]azanium

Systemtic Name: [(1S)-1-(2,3-dimethylphenyl)-3-ethoxy-3-oxidanylidene-propyl]azanium Openeye Name: [(1S)-1-(2,3-dimethylphenyl)-3-ethoxy-3-oxo-propyl]ammonium CAS Name: [(1S)-1-(2,3-dimethylphenyl)-3-ethoxy-3-oxopropyl]ammonium IUPAC Name: [(1S)-1-(2,3-dimethylphenyl)-3-ethoxy-3-oxopropyl]azanium Traditional Name: [(1S)-1-(2,3-dimethylphenyl)-3-ethoxy-3-keto-propyl]ammonium Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC(=C1C)C)[NH3+]

Isomeric SMILES

CCOC(=O)C[C@@H](C1=CC=CC(=C1C)C)[NH3+]

InChI

InChI=1S/C13H19NO2/c1-4-16-13(15)8-12(14)11-7-5-6-9(2)10(11)3/h5-7,12H,4,8,14H2,1-3H3/p+1/t12-/m0/s1