[(4R)-1-[(4-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxo-azepan-4-yl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxo-4-azepanyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxoazepan-4-yl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(4R)-1-(4-fluorobenzyl)-7-keto-azepan-4-yl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C21H27FN3O+ MolecularWeight: 356.456983

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)[C@@H]2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O/c1-24(14-11-19-4-2-3-13-23-19)20-9-10-21(26)25(15-12-20)16-17-5-7-18(22)8-6-17/h2-8,13,20H,9-12,14-16H2,1H3/p+1/t20-/m1/s1