[(1S)-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-ethoxy-3-oxidanylidene-propyl]azanium

Systemtic Name: [(1S)-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-ethoxy-3-oxidanylidene-propyl]azanium Openeye Name: [(1S)-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-ethoxy-3-oxo-propyl]ammonium CAS Name: [(1S)-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-ethoxy-3-oxopropyl]ammonium IUPAC Name: [(1S)-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-ethoxy-3-oxopropyl]azanium Traditional Name: [(1S)-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-ethoxy-3-keto-propyl]ammonium Formula: C12H14ClF3NO2+ MolecularWeight: 296.69327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClF3NO2/c1-2-19-11(18)6-10(17)8-5-7(12(14,15)16)3-4-9(8)13/h3-5,10H,2,6,17H2,1H3/p+1/t10-/m0/s1