[3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C17H20ClFN3O2+ MolecularWeight: 352.811003

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C17H19ClFN3O2/c1-3-21-7-9-22(10-8-21)17(23)14-11(2)24-20-16(14)15-12(18)5-4-6-13(15)19/h4-6H,3,7-10H2,1-2H3/p+1