N-(2,4-dimethyl-3-oxidanyl-phenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanamide chloride

Systemtic Name: N-(2,4-dimethyl-3-oxidanyl-phenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanamide chloride Openeye Name: N-(3-hydroxy-2,4-dimethyl-phenyl)-2-(3-methylimidazol-3-ium-1-yl)acetamide chloride CAS Name: N-(3-hydroxy-2,4-dimethylphenyl)-2-(3-methyl-1-imidazol-3-iumyl)acetamide chloride IUPAC Name: N-(3-hydroxy-2,4-dimethylphenyl)-2-(3-methylimidazol-3-ium-1-yl)acetamide chloride Traditional Name: N-(3-hydroxy-2,4-dimethyl-phenyl)-2-(3-methylimidazol-3-ium-1-yl)acetamide chloride Formula: C14H18ClN3O2 MolecularWeight: 295.76462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)NC(=O)CN2C=C[N+](=C2)C)C)O.[Cl-]

Isomeric SMILES

CC1=C(C(=C(C=C1)NC(=O)CN2C=C[N+](=C2)C)C)O.[Cl-]

InChI

InChI=1S/C14H17N3O2.ClH/c1-10-4-5-12(11(2)14(10)19)15-13(18)8-17-7-6-16(3)9-17;/h4-7,9H,8H2,1-3H3,(H-,15,18,19);1H