[(2S)-3-azaniumyl-2-oxidanyl-propyl]-[(4-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium

Systemtic Name: [(2S)-3-azaniumyl-2-oxidanyl-propyl]-[(4-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium Openeye Name: [(2S)-3-azaniumyl-2-hydroxy-propyl]-[(4-fluorophenyl)methyl]-(2-furylmethyl)ammonium CAS Name: [(2S)-3-ammonio-2-hydroxypropyl]-[(4-fluorophenyl)methyl]-(2-furanylmethyl)ammonium IUPAC Name: [(2S)-3-azaniumyl-2-hydroxypropyl]-[(4-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium Traditional Name: [(2S)-3-ammonio-2-hydroxy-propyl]-(4-fluorobenzyl)-(2-furfuryl)ammonium Formula: C15H21FN2O2+2 MolecularWeight: 280.337843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C[NH+](CC2=CC=C(C=C2)F)CC(C[NH3+])O

Isomeric SMILES

C1=COC(=C1)C[NH+](CC2=CC=C(C=C2)F)C[C@H](C[NH3+])O

InChI

InChI=1S/C15H19FN2O2/c16-13-5-3-12(4-6-13)9-18(10-14(19)8-17)11-15-2-1-7-20-15/h1-7,14,19H,8-11,17H2/p+2/t14-/m0/s1