N4-(4-methoxyphenyl)-N4,1-dimethyl-N2-(2-methylphenyl)quinazolin-1-ium-2,4-diamine iodide

Systemtic Name: N4-(4-methoxyphenyl)-N4,1-dimethyl-N2-(2-methylphenyl)quinazolin-1-ium-2,4-diamine iodide Openeye Name: N4-(4-methoxyphenyl)-N4,1-dimethyl-N2-(o-tolyl)quinazolin-1-ium-2,4-diamine iodide CAS Name: N4-(4-methoxyphenyl)-N4,1-dimethyl-N2-(2-methylphenyl)quinazolin-1-ium-2,4-diamine iodide IUPAC Name: 4-N-(4-methoxyphenyl)-4-N,1-dimethyl-2-N-(2-methylphenyl)quinazolin-1-ium-2,4-diamine iodide Traditional Name: (4-methoxyphenyl)-methyl-[1-methyl-2-(o-toluidino)quinazolin-1-ium-4-yl]amine iodide Formula: C24H25IN4O MolecularWeight: 512.38597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=[N+](C3=CC=CC=C3C(=N2)N(C)C4=CC=C(C=C4)OC)C.[I-]

Isomeric SMILES

CC1=CC=CC=C1NC2=[N+](C3=CC=CC=C3C(=N2)N(C)C4=CC=C(C=C4)OC)C.[I-]

InChI

InChI=1S/C24H24N4O.HI/c1-17-9-5-7-11-21(17)25-24-26-23(20-10-6-8-12-22(20)28(24)3)27(2)18-13-15-19(29-4)16-14-18;/h5-16H,1-4H3;1H