(4-fluorophenyl)methyl-bis[(2S)-3-(furan-2-ylmethoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: (4-fluorophenyl)methyl-bis[(2S)-3-(furan-2-ylmethoxy)-2-oxidanyl-propyl]azanium Openeye Name: (4-fluorophenyl)methyl-bis[(2S)-3-(2-furylmethoxy)-2-hydroxy-propyl]ammonium CAS Name: (4-fluorophenyl)methyl-bis[(2S)-3-(2-furanylmethoxy)-2-hydroxypropyl]ammonium IUPAC Name: (4-fluorophenyl)methyl-bis[(2S)-3-(furan-2-ylmethoxy)-2-hydroxypropyl]azanium Traditional Name: (4-fluorobenzyl)-bis[(2S)-3-(2-furfuryloxy)-2-hydroxy-propyl]ammonium Formula: C23H29FNO6+ MolecularWeight: 434.477863

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)COCC(C[NH+](CC2=CC=C(C=C2)F)CC(COCC3=CC=CO3)O)O

Isomeric SMILES

C1=COC(=C1)COC[C@H](C[NH+](CC2=CC=C(C=C2)F)C[C@@H](COCC3=CC=CO3)O)O

InChI

InChI=1S/C23H28FNO6/c24-19-7-5-18(6-8-19)11-25(12-20(26)14-28-16-22-3-1-9-30-22)13-21(27)15-29-17-23-4-2-10-31-23/h1-10,20-21,26-27H,11-17H2/p+1/t20-,21-/m0/s1