[3,4-bis(fluoranyl)phenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [3,4-bis(fluoranyl)phenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (3,4-difluorophenyl)-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: (3,4-difluorophenyl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3,4-difluorophenyl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (3,4-difluorophenyl)-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C13H17F2N2O+ MolecularWeight: 255.283686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H16F2N2O/c1-2-16-5-7-17(8-6-16)13(18)10-3-4-11(14)12(15)9-10/h3-4,9H,2,5-8H2,1H3/p+1