N-(4-hydroxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanamide tetrafluoroborate

Systemtic Name: N-(4-hydroxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanamide tetrafluoroborate Openeye Name: N-(4-hydroxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)acetamide tetrafluoroborate CAS Name: N-(4-hydroxyphenyl)-2-(3-methyl-1-imidazol-3-iumyl)acetamide tetrafluoroborate IUPAC Name: N-(4-hydroxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)acetamide tetrafluoroborate Traditional Name: N-(4-hydroxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)acetamide tetrafluoroborate Formula: C12H14BF4N3O2 MolecularWeight: 319.063073

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=CN(C=C1)CC(=O)NC2=CC=C(C=C2)O

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=CN(C=C1)CC(=O)NC2=CC=C(C=C2)O

InChI

InChI=1S/C12H13N3O2.BF4/c1-14-6-7-15(9-14)8-12(17)13-10-2-4-11(16)5-3-10;2-1(3,4)5/h2-7,9H,8H2,1H3,(H-,13,16,17);/q;-1/p+1