[(3S)-1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl]-methyl-azanium

Systemtic Name: [(3S)-1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl]-methyl-azanium Openeye Name: [(3S)-1-(4-fluorobenzoyl)-2-oxo-azepan-3-yl]-methyl-ammonium CAS Name: [(3S)-1-[(4-fluorophenyl)-oxomethyl]-2-oxo-3-azepanyl]-methylammonium IUPAC Name: [(3S)-1-(4-fluorobenzoyl)-2-oxoazepan-3-yl]-methylazanium Traditional Name: [(3S)-1-(4-fluorobenzoyl)-2-keto-azepan-3-yl]-methyl-ammonium Formula: C14H18FN2O2+ MolecularWeight: 265.303323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C1CCCCN(C1=O)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C[NH2+][C@H]1CCCCN(C1=O)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H17FN2O2/c1-16-12-4-2-3-9-17(14(12)19)13(18)10-5-7-11(15)8-6-10/h5-8,12,16H,2-4,9H2,1H3/p+1/t12-/m0/s1