(2R)-3-chloranyl-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-fluoranyl-propan-1-one

Systemtic Name: (2R)-3-chloranyl-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-fluoranyl-propan-1-one Openeye Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-chloro-2-fluoro-propan-1-one CAS Name: (2R)-3-chloro-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-fluoro-1-propanone IUPAC Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-chloro-2-fluoropropan-1-one Traditional Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-chloro-2-fluoro-propan-1-one Formula: C20H23ClFN2O+ MolecularWeight: 361.860823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C(CCl)F

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)[C@H](CCl)F

InChI

InChI=1S/C20H22ClFN2O/c21-15-18(22)20(25)24-13-11-23(12-14-24)19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2/p+1/t18-/m0/s1