N'-[2-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanoyl]benzohydrazide

Systemtic Name: N'-[2-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanoyl]benzohydrazide Openeye Name: N'-[2-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-ium-1-yl]acetyl]benzohydrazide CAS Name: N'-[2-[4-(5-fluoro-1-benzotriazolyl)-1-piperidin-1-iumyl]-1-oxoethyl]benzohydrazide IUPAC Name: N'-[2-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-ium-1-yl]acetyl]benzohydrazide Traditional Name: N'-[2-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-ium-1-yl]acetyl]benzohydrazide Formula: C20H22FN6O2+ MolecularWeight: 397.426083

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C3=C(C=C(C=C3)F)N=N2)CC(=O)NNC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1N2C3=C(C=C(C=C3)F)N=N2)CC(=O)NNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21FN6O2/c21-15-6-7-18-17(12-15)22-25-27(18)16-8-10-26(11-9-16)13-19(28)23-24-20(29)14-4-2-1-3-5-14/h1-7,12,16H,8-11,13H2,(H,23,28)(H,24,29)/p+1