[(1S,2R)-2-(3-fluoranylphenoxy)cyclododecyl]azanium

Systemtic Name: [(1S,2R)-2-(3-fluoranylphenoxy)cyclododecyl]azanium Openeye Name: [(1S,2R)-2-(3-fluorophenoxy)cyclododecyl]ammonium CAS Name: [(1S,2R)-2-(3-fluorophenoxy)cyclododecyl]ammonium IUPAC Name: [(1S,2R)-2-(3-fluorophenoxy)cyclododecyl]azanium Traditional Name: [(1S,2R)-2-(3-fluorophenoxy)cyclododecyl]ammonium Formula: C18H29FNO+ MolecularWeight: 294.427363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(C(CCCC1)[NH3+])OC2=CC(=CC=C2)F

Isomeric SMILES

C1CCCCC[C@H]([C@H](CCCC1)[NH3+])OC2=CC(=CC=C2)F

InChI

InChI=1S/C18H28FNO/c19-15-10-9-11-16(14-15)21-18-13-8-6-4-2-1-3-5-7-12-17(18)20/h9-11,14,17-18H,1-8,12-13,20H2/p+1/t17-,18+/m0/s1