2-azanylethanoyl-[2,5-bis(fluoranyl)phenyl]-(2-ethoxy-2-oxidanylidene-ethyl)-methyl-azanium

Systemtic Name: 2-azanylethanoyl-[2,5-bis(fluoranyl)phenyl]-(2-ethoxy-2-oxidanylidene-ethyl)-methyl-azanium Openeye Name: (2-aminoacetyl)-(2,5-difluorophenyl)-(2-ethoxy-2-oxo-ethyl)-methyl-ammonium CAS Name: (2-amino-1-oxoethyl)-(2,5-difluorophenyl)-(2-ethoxy-2-oxoethyl)-methylammonium IUPAC Name: (2-aminoacetyl)-(2,5-difluorophenyl)-(2-ethoxy-2-oxoethyl)-methylazanium Traditional Name: (2,5-difluorophenyl)-(2-ethoxy-2-keto-ethyl)-glycyl-methyl-ammonium Formula: C13H17F2N2O3+ MolecularWeight: 287.282486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+](C)(C1=C(C=CC(=C1)F)F)C(=O)CN

Isomeric SMILES

CCOC(=O)C[N+](C)(C1=C(C=CC(=C1)F)F)C(=O)CN

InChI

InChI=1S/C13H17F2N2O3/c1-3-20-13(19)8-17(2,12(18)7-16)11-6-9(14)4-5-10(11)15/h4-6H,3,7-8,16H2,1-2H3/q+1