2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-1H-imidazol-1-ium; hydron; phosphate

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-1H-imidazol-1-ium; hydron; phosphate Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-1H-imidazol-1-ium; hydron; phosphate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-1H-imidazol-1-ium; hydron; phosphate IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-1H-imidazol-1-ium; hydron; phosphate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-1H-imidazol-1-ium; hydron; phosphate Formula: C14H19N2O6P MolecularWeight: 342.284221

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].CC[NH+]1C=CN=C1CC2COC3=CC=CC=C3O2.[O-]P(=O)([O-])[O-]

Isomeric SMILES

[H+].[H+].CC[NH+]1C=CN=C1CC2COC3=CC=CC=C3O2.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C14H16N2O2.H3O4P/c1-2-16-8-7-15-14(16)9-11-10-17-12-5-3-4-6-13(12)18-11;1-5(2,3)4/h3-8,11H,2,9-10H2,1H3;(H3,1,2,3,4)