4-(azocan-1-ium-1-ylmethyl)-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-(azocan-1-ium-1-ylmethyl)-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-(azocan-1-ium-1-ylmethyl)-3-fluoro-N'-hydroxy-benzamidine CAS Name: 4-(1-azocan-1-iumylmethyl)-3-fluoro-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-(azocan-1-ium-1-ylmethyl)-3-fluoro-N'-hydroxybenzenecarboximidamide Traditional Name: 4-(azocan-1-ium-1-ylmethyl)-3-fluoro-N'-hydroxy-benzamidine Formula: C15H23FN3O+ MolecularWeight: 280.361023

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC2=C(C=C(C=C2)C(=NO)N)F

Isomeric SMILES

C1CCC[NH+](CCC1)CC2=C(C=C(C=C2)/C(=N\O)/N)F

InChI

InChI=1S/C15H22FN3O/c16-14-10-12(15(17)18-20)6-7-13(14)11-19-8-4-2-1-3-5-9-19/h6-7,10,20H,1-5,8-9,11H2,(H2,17,18)/p+1