2-[4-(benzotriazol-1-yl)piperidin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[4-(benzotriazol-1-yl)piperidin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[4-(benzotriazol-1-yl)piperidin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[4-(1-benzotriazolyl)-1-piperidin-1-iumyl]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[4-(benzotriazol-1-yl)piperidin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[4-(benzotriazol-1-yl)piperidin-1-ium-1-yl]-N-(4-fluorobenzyl)acetamide Formula: C20H23FN5O+ MolecularWeight: 368.427923

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C3=CC=CC=C3N=N2)CC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1N2C3=CC=CC=C3N=N2)CC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C20H22FN5O/c21-16-7-5-15(6-8-16)13-22-20(27)14-25-11-9-17(10-12-25)26-19-4-2-1-3-18(19)23-24-26/h1-8,17H,9-14H2,(H,22,27)/p+1