N-(4-methyl-3-oxidanyl-phenyl)-2-(2-methylpyrazol-2-ium-1-yl)ethanamide chloride

Systemtic Name: N-(4-methyl-3-oxidanyl-phenyl)-2-(2-methylpyrazol-2-ium-1-yl)ethanamide chloride Openeye Name: N-(3-hydroxy-4-methyl-phenyl)-2-(2-methylpyrazol-2-ium-1-yl)acetamide chloride CAS Name: N-(3-hydroxy-4-methylphenyl)-2-(2-methyl-1-pyrazol-2-iumyl)acetamide chloride IUPAC Name: N-(3-hydroxy-4-methylphenyl)-2-(2-methylpyrazol-2-ium-1-yl)acetamide chloride Traditional Name: N-(3-hydroxy-4-methyl-phenyl)-2-(2-methylpyrazol-2-ium-1-yl)acetamide chloride Formula: C13H16ClN3O2 MolecularWeight: 281.73804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C=CC=[N+]2C)O.[Cl-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C=CC=[N+]2C)O.[Cl-]

InChI

InChI=1S/C13H15N3O2.ClH/c1-10-4-5-11(8-12(10)17)14-13(18)9-16-7-3-6-15(16)2;/h3-8H,9H2,1-2H3,(H-,14,17,18);1H