[(2R)-1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-2-yl]methylazanium

Systemtic Name: [(2R)-1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-2-yl]methylazanium Openeye Name: [(2R)-1-[2-(4-fluoroanilino)-2-oxo-ethyl]piperidin-1-ium-2-yl]methylammonium CAS Name: [(2R)-1-[2-(4-fluoroanilino)-2-oxoethyl]-2-piperidin-1-iumyl]methylammonium IUPAC Name: [(2R)-1-[2-(4-fluoroanilino)-2-oxoethyl]piperidin-1-ium-2-yl]methylazanium Traditional Name: [(2R)-1-[2-(4-fluoroanilino)-2-keto-ethyl]piperidin-1-ium-2-yl]methylammonium Formula: C14H22FN3O+2 MolecularWeight: 267.342383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C[NH3+])CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C1CC[NH+]([C@H](C1)C[NH3+])CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C14H20FN3O/c15-11-4-6-12(7-5-11)17-14(19)10-18-8-2-1-3-13(18)9-16/h4-7,13H,1-3,8-10,16H2,(H,17,19)/p+2/t13-/m1/s1