4-[[(5R)-5-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl]methyl]benzene-1,2-diol chloride

Systemtic Name: 4-[[(5R)-5-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl]methyl]benzene-1,2-diol chloride Openeye Name: 4-[[(5R)-5-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl]methyl]benzene-1,2-diol chloride CAS Name: 4-[[(5R)-5-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl]methyl]benzene-1,2-diol chloride IUPAC Name: 4-[[(5R)-5-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl]methyl]benzene-1,2-diol chloride Traditional Name: 4-[[(4R)-4-methyl-2-imidazolin-1-ium-2-yl]methyl]pyrocatechol chloride Formula: C11H15ClN2O2 MolecularWeight: 242.702

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+]=C(N1)CC2=CC(=C(C=C2)O)O.[Cl-]

Isomeric SMILES

C[C@@H]1C[NH+]=C(N1)CC2=CC(=C(C=C2)O)O.[Cl-]

InChI

InChI=1S/C11H14N2O2.ClH/c1-7-6-12-11(13-7)5-8-2-3-9(14)10(15)4-8;/h2-4,7,14-15H,5-6H2,1H3,(H,12,13);1H/t7-;/m1./s1