N-(2-chloranyl-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-ethanamide iodide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-ethanamide iodide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-acetamide iodide CAS Name: N-(2-chloro-6-methylphenyl)-2-(2-phthalazin-2-iumyl)acetamide iodide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-phthalazin-2-ium-2-ylacetamide iodide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-acetamide iodide Formula: C17H15ClIN3O MolecularWeight: 439.67797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C[N+]2=CC3=CC=CC=C3C=N2.[I-]

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C[N+]2=CC3=CC=CC=C3C=N2.[I-]

InChI

InChI=1S/C17H14ClN3O.HI/c1-12-5-4-8-15(18)17(12)20-16(22)11-21-10-14-7-3-2-6-13(14)9-19-21;/h2-10H,11H2,1H3;1H