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

Systemtic Name: [(4R)-1-[(2-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-phenethyl-azanium Openeye Name: [(4R)-1-[(2-fluorophenyl)methyl]-7-oxo-azepan-4-yl]-methyl-phenethyl-ammonium CAS Name: [(4R)-1-[(2-fluorophenyl)methyl]-7-oxo-4-azepanyl]-methyl-phenethylammonium IUPAC Name: [(4R)-1-[(2-fluorophenyl)methyl]-7-oxoazepan-4-yl]-methyl-phenethylazanium Traditional Name: [(4R)-1-(2-fluorobenzyl)-7-keto-azepan-4-yl]-methyl-phenethyl-ammonium Formula: C22H28FN2O+ MolecularWeight: 355.468923

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCC(=O)N(CC2)CC3=CC=CC=C3F

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@@H]2CCC(=O)N(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2O/c1-24(15-13-18-7-3-2-4-8-18)20-11-12-22(26)25(16-14-20)17-19-9-5-6-10-21(19)23/h2-10,20H,11-17H2,1H3/p+1/t20-/m1/s1