[5-fluoranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [5-fluoranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]-piperazin-4-ium-1-yl-methanone Openeye Name: [5-fluoro-2-(tetrazol-1-yl)phenyl]-piperazin-4-ium-1-yl-methanone CAS Name: [5-fluoro-2-(1-tetrazolyl)phenyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: [5-fluoro-2-(tetrazol-1-yl)phenyl]-piperazin-4-ium-1-ylmethanone Traditional Name: [5-fluoro-2-(tetrazol-1-yl)phenyl]-piperazin-4-ium-1-yl-methanone Formula: C12H14FN6O+ MolecularWeight: 277.277563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=C(C=CC(=C2)F)N3C=NN=N3

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=C(C=CC(=C2)F)N3C=NN=N3

InChI

InChI=1S/C12H13FN6O/c13-9-1-2-11(19-8-15-16-17-19)10(7-9)12(20)18-5-3-14-4-6-18/h1-2,7-8,14H,3-6H2/p+1