4-[[5-(4-fluorophenyl)-2-oxidanylidene-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[[5-(4-fluorophenyl)-2-oxidanylidene-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]methyl]-N-phenylpiperazin-4-ium-1-carboxamide Traditional Name: 4-[[5-(4-fluorophenyl)-2-keto-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperazin-4-ium-1-carboxamide Formula: C20H21FN5O3+ MolecularWeight: 398.410843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)OC(=N2)C3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)OC(=N2)C3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H20FN5O3/c21-16-8-6-15(7-9-16)18-23-26(20(28)29-18)14-24-10-12-25(13-11-24)19(27)22-17-4-2-1-3-5-17/h1-9H,10-14H2,(H,22,27)/p+1