3-[[3,4-bis(fluoranyl)phenyl]-(2-methylpropanoyl)amino]propylazanium

Systemtic Name: 3-[[3,4-bis(fluoranyl)phenyl]-(2-methylpropanoyl)amino]propylazanium Openeye Name: 3-[3,4-difluoro-N-(2-methylpropanoyl)anilino]propylammonium CAS Name: 3-(3,4-difluoro-N-(2-methyl-1-oxopropyl)anilino)propylammonium IUPAC Name: 3-[3,4-difluoro-N-(2-methylpropanoyl)anilino]propylazanium Traditional Name: 3-(3,4-difluoro-N-isobutyryl-anilino)propylammonium Formula: C13H19F2N2O+ MolecularWeight: 257.299566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18F2N2O/c1-9(2)13(18)17(7-3-6-16)10-4-5-11(14)12(15)8-10/h4-5,8-9H,3,6-7,16H2,1-2H3/p+1