[3-[3,3,3-tris(fluoranyl)propanoylamino]phenyl]methylazanium

Systemtic Name: [3-[3,3,3-tris(fluoranyl)propanoylamino]phenyl]methylazanium Openeye Name: [3-(3,3,3-trifluoropropanoylamino)phenyl]methylammonium CAS Name: [3-[(3,3,3-trifluoro-1-oxopropyl)amino]phenyl]methylammonium IUPAC Name: [3-(3,3,3-trifluoropropanoylamino)phenyl]methylazanium Traditional Name: [3-(3,3,3-trifluoropropanoylamino)benzyl]ammonium Formula: C10H12F3N2O+ MolecularWeight: 233.21029

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11F3N2O/c11-10(12,13)5-9(16)15-8-3-1-2-7(4-8)6-14/h1-4H,5-6,14H2,(H,15,16)/p+1