cyclopropyl-[(4-fluorophenyl)methyl]-[(2R)-3-(3-methoxycarbonylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(2R)-3-(3-methoxycarbonylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(2R)-2-hydroxy-3-(3-methoxycarbonylphenoxy)propyl]ammonium CAS Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(2R)-2-hydroxy-3-(3-methoxycarbonylphenoxy)propyl]ammonium IUPAC Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(2R)-2-hydroxy-3-(3-methoxycarbonylphenoxy)propyl]azanium Traditional Name: [(2R)-3-(3-carbomethoxyphenoxy)-2-hydroxy-propyl]-cyclopropyl-(4-fluorobenzyl)ammonium Formula: C21H25FNO4+ MolecularWeight: 374.425903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(C[NH+](CC2=CC=C(C=C2)F)C3CC3)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OC[C@@H](C[NH+](CC2=CC=C(C=C2)F)C3CC3)O

InChI

InChI=1S/C21H24FNO4/c1-26-21(25)16-3-2-4-20(11-16)27-14-19(24)13-23(18-9-10-18)12-15-5-7-17(22)8-6-15/h2-8,11,18-19,24H,9-10,12-14H2,1H3/p+1/t19-/m1/s1