2-[4-(3,4-dimethoxyphenyl)pyrimidin-1-ium-1-yl]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)pyrimidin-1-ium-1-yl]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[4-(3,4-dimethoxyphenyl)pyrimidin-1-ium-1-yl]-N-(o-tolyl)acetamide CAS Name: 2-[4-(3,4-dimethoxyphenyl)-1-pyrimidin-1-iumyl]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)pyrimidin-1-ium-1-yl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[4-(3,4-dimethoxyphenyl)pyrimidin-1-ium-1-yl]-N-(o-tolyl)acetamide Formula: C21H22N3O3+ MolecularWeight: 364.41768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C[N+]2=CN=C(C=C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C[N+]2=CN=C(C=C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21N3O3/c1-15-6-4-5-7-17(15)23-21(25)13-24-11-10-18(22-14-24)16-8-9-19(26-2)20(12-16)27-3/h4-12,14H,13H2,1-3H3/p+1