2-[[3,4-bis(fluoranyl)phenyl]-(3-phenylpropanoyl)amino]ethylazanium

Systemtic Name: 2-[[3,4-bis(fluoranyl)phenyl]-(3-phenylpropanoyl)amino]ethylazanium Openeye Name: 2-[3,4-difluoro-N-(3-phenylpropanoyl)anilino]ethylammonium CAS Name: 2-(3,4-difluoro-N-(1-oxo-3-phenylpropyl)anilino)ethylammonium IUPAC Name: 2-[3,4-difluoro-N-(3-phenylpropanoyl)anilino]ethylazanium Traditional Name: 2-(3,4-difluoro-N-hydrocinnamoyl-anilino)ethylammonium Formula: C17H19F2N2O+ MolecularWeight: 305.342366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N(CC[NH3+])C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N(CC[NH3+])C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C17H18F2N2O/c18-15-8-7-14(12-16(15)19)21(11-10-20)17(22)9-6-13-4-2-1-3-5-13/h1-5,7-8,12H,6,9-11,20H2/p+1