[(2S)-3-[4-bromanyl-2,6-bis(fluoranyl)phenoxy]-2-oxidanyl-propyl]-cyclopentyl-azanium

Systemtic Name: [(2S)-3-[4-bromanyl-2,6-bis(fluoranyl)phenoxy]-2-oxidanyl-propyl]-cyclopentyl-azanium Openeye Name: [(2S)-3-(4-bromo-2,6-difluoro-phenoxy)-2-hydroxy-propyl]-cyclopentyl-ammonium CAS Name: [(2S)-3-(4-bromo-2,6-difluorophenoxy)-2-hydroxypropyl]-cyclopentylammonium IUPAC Name: [(2S)-3-(4-bromo-2,6-difluorophenoxy)-2-hydroxypropyl]-cyclopentylazanium Traditional Name: [(2S)-3-(4-bromo-2,6-difluoro-phenoxy)-2-hydroxy-propyl]-cyclopentyl-ammonium Formula: C14H19BrF2NO2+ MolecularWeight: 351.206966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH2+]CC(COC2=C(C=C(C=C2F)Br)F)O

Isomeric SMILES

C1CCC(C1)[NH2+]C[C@@H](COC2=C(C=C(C=C2F)Br)F)O

InChI

InChI=1S/C14H18BrF2NO2/c15-9-5-12(16)14(13(17)6-9)20-8-11(19)7-18-10-3-1-2-4-10/h5-6,10-11,18-19H,1-4,7-8H2/p+1/t11-/m0/s1