3-fluoranyl-N-(4-oxidanylidene-4-piperazin-4-ium-1-yl-butyl)benzamide

Systemtic Name: 3-fluoranyl-N-(4-oxidanylidene-4-piperazin-4-ium-1-yl-butyl)benzamide Openeye Name: 3-fluoro-N-(4-oxo-4-piperazin-4-ium-1-yl-butyl)benzamide CAS Name: 3-fluoro-N-[4-oxo-4-(1-piperazin-4-iumyl)butyl]benzamide IUPAC Name: 3-fluoro-N-(4-oxo-4-piperazin-4-ium-1-ylbutyl)benzamide Traditional Name: 3-fluoro-N-(4-keto-4-piperazin-4-ium-1-yl-butyl)benzamide Formula: C15H21FN3O2+ MolecularWeight: 294.344543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)CCCNC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)CCCNC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C15H20FN3O2/c16-13-4-1-3-12(11-13)15(21)18-6-2-5-14(20)19-9-7-17-8-10-19/h1,3-4,11,17H,2,5-10H2,(H,18,21)/p+1