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1,3-dimethylimidazol-1-ium benzoate

1,3-dimethylimidazol-1-ium benzoate

Systemtic Name:1,3-dimethylimidazol-1-ium benzoate
Openeye Name:1,3-dimethylimidazol-1-ium benzoate
CAS Name:1,3-dimethylimidazol-1-ium benzoate
IUPAC Name:1,3-dimethylimidazol-1-ium benzoate
Traditional Name:1,3-dimethylimidazol-1-ium benzoate
Formula: C12H14N2O2
MolecularWeight: 218.25176
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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1)C.C1=CC=C(C=C1)C(=O)[O-]


Isomeric SMILES

CN1C=C[N+](=C1)C.C1=CC=C(C=C1)C(=O)[O-]


InChI

InChI=1S/C7H6O2.C5H9N2/c8-7(9)6-4-2-1-3-5-6;1-6-3-4-7(2)5-6/h1-5H,(H,8,9);3-5H,1-2H3/q;+1/p-1


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