3-[[(3R)-3-(4-fluorophenyl)-3-(furan-2-yl)propanoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3R)-3-(4-fluorophenyl)-3-(furan-2-yl)propanoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(3R)-3-(4-fluorophenyl)-3-(2-furyl)propanoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(3R)-3-(4-fluorophenyl)-3-(2-furanyl)-1-oxopropyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3R)-3-(4-fluorophenyl)-3-(furan-2-yl)propanoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(3R)-3-(4-fluorophenyl)-3-(2-furyl)propanoyl]amino]propyl-dimethyl-ammonium Formula: C18H24FN2O2+ MolecularWeight: 319.393763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)CC(C1=CC=C(C=C1)F)C2=CC=CO2

Isomeric SMILES

C[NH+](C)CCCNC(=O)C[C@H](C1=CC=C(C=C1)F)C2=CC=CO2

InChI

InChI=1S/C18H23FN2O2/c1-21(2)11-4-10-20-18(22)13-16(17-5-3-12-23-17)14-6-8-15(19)9-7-14/h3,5-9,12,16H,4,10-11,13H2,1-2H3,(H,20,22)/p+1/t16-/m1/s1