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

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-ethanamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-acetamide CAS Name: N-(2-chloro-6-methylphenyl)-2-(2-phthalazin-2-iumyl)acetamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-phthalazin-2-ium-2-ylacetamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-phthalazin-2-ium-2-yl-acetamide Formula: C17H15ClN3O+ MolecularWeight: 312.7735

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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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN3O/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/p+1