3-[pyridin-3-ylmethyl-[3,3,3-tris(fluoranyl)propanoyl]amino]propylazanium

Systemtic Name: 3-[pyridin-3-ylmethyl-[3,3,3-tris(fluoranyl)propanoyl]amino]propylazanium Openeye Name: 3-[3-pyridylmethyl(3,3,3-trifluoropropanoyl)amino]propylammonium CAS Name: 3-[3-pyridinylmethyl-(3,3,3-trifluoro-1-oxopropyl)amino]propylammonium IUPAC Name: 3-[pyridin-3-ylmethyl(3,3,3-trifluoropropanoyl)amino]propylazanium Traditional Name: 3-[3-pyridylmethyl(3,3,3-trifluoropropanoyl)amino]propylammonium Formula: C12H17F3N3O+ MolecularWeight: 276.27809

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16F3N3O/c13-12(14,15)7-11(19)18(6-2-4-16)9-10-3-1-5-17-8-10/h1,3,5,8H,2,4,6-7,9,16H2/p+1