[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [2-[(3-fluoro-4-methyl-phenyl)methylamino]-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]-(2-furanylmethyl)-methylammonium IUPAC Name: [2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [2-[(3-fluoro-4-methyl-benzyl)amino]-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C16H20FN2O2+ MolecularWeight: 291.340603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C[NH+](C)CC2=CC=CO2)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C[NH+](C)CC2=CC=CO2)F

InChI

InChI=1S/C16H19FN2O2/c1-12-5-6-13(8-15(12)17)9-18-16(20)11-19(2)10-14-4-3-7-21-14/h3-8H,9-11H2,1-2H3,(H,18,20)/p+1