4-[[(3S)-3-(3-fluorophenyl)oxolan-3-yl]methyl]-1,4-oxazepan-4-ium

Systemtic Name: 4-[[(3S)-3-(3-fluorophenyl)oxolan-3-yl]methyl]-1,4-oxazepan-4-ium Openeye Name: 4-[[(3S)-3-(3-fluorophenyl)tetrahydrofuran-3-yl]methyl]-1,4-oxazepan-4-ium CAS Name: 4-[[(3S)-3-(3-fluorophenyl)-3-oxolanyl]methyl]-1,4-oxazepan-4-ium IUPAC Name: 4-[[(3S)-3-(3-fluorophenyl)oxolan-3-yl]methyl]-1,4-oxazepan-4-ium Traditional Name: 4-[[(3S)-3-(3-fluorophenyl)tetrahydrofuran-3-yl]methyl]-1,4-oxazepan-4-ium Formula: C16H23FNO2+ MolecularWeight: 280.357723

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCOC1)CC2(CCOC2)C3=CC(=CC=C3)F

Isomeric SMILES

C1C[NH+](CCOC1)C[C@]2(CCOC2)C3=CC(=CC=C3)F

InChI

InChI=1S/C16H22FNO2/c17-15-4-1-3-14(11-15)16(5-9-20-13-16)12-18-6-2-8-19-10-7-18/h1,3-4,11H,2,5-10,12-13H2/p+1/t16-/m0/s1