N-(4-chloranyl-2-fluoranyl-phenyl)-2-[4-(2-morpholin-4-ium-4-ylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-[4-(2-morpholin-4-ium-4-ylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[4-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-ium-1-yl]acetamide Formula: C18H26ClFN4O3+2 MolecularWeight: 400.875443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)C[NH+]3CCOCC3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C18H24ClFN4O3/c19-14-1-2-16(15(20)11-14)21-17(25)12-22-3-5-24(6-4-22)18(26)13-23-7-9-27-10-8-23/h1-2,11H,3-10,12-13H2,(H,21,25)/p+2