4-(4,5-dihydro-1H-imidazol-3-ium-3-ylmethyl)benzene-1,2-diol chloride

Systemtic Name: 4-(4,5-dihydro-1H-imidazol-3-ium-3-ylmethyl)benzene-1,2-diol chloride Openeye Name: 4-(4,5-dihydro-1H-imidazol-3-ium-3-ylmethyl)benzene-1,2-diol chloride CAS Name: 4-(4,5-dihydro-1H-imidazol-3-ium-3-ylmethyl)benzene-1,2-diol chloride IUPAC Name: 4-(4,5-dihydro-1H-imidazol-3-ium-3-ylmethyl)benzene-1,2-diol chloride Traditional Name: 4-(2-imidazolin-1-ium-1-ylmethyl)pyrocatechol chloride Formula: C10H13ClN2O2 MolecularWeight: 228.67542

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=CN1)CC2=CC(=C(C=C2)O)O.[Cl-]

Isomeric SMILES

C1C[N+](=CN1)CC2=CC(=C(C=C2)O)O.[Cl-]

InChI

InChI=1S/C10H12N2O2.ClH/c13-9-2-1-8(5-10(9)14)6-12-4-3-11-7-12;/h1-2,5,7,13-14H,3-4,6H2;1H