1-methyl-1H-imidazol-1-ium benzoate

Systemtic Name: 1-methyl-1H-imidazol-1-ium benzoate Openeye Name: 1-methyl-1H-imidazol-1-ium benzoate CAS Name: 1-methyl-1H-imidazol-1-ium benzoate IUPAC Name: 1-methyl-1H-imidazol-1-ium benzoate Traditional Name: 1-methyl-1H-imidazol-1-ium benzoate Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C=CN=C1.C1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

C[NH+]1C=CN=C1.C1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C7H6O2.C4H6N2/c8-7(9)6-4-2-1-3-5-6;1-6-3-2-5-4-6/h1-5H,(H,8,9);2-4H,1H3