2-(3-methylimidazol-3-ium-1-yl)ethyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-(3-methyl-1-imidazol-3-iumyl)ethyl ester IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-chlorophenyl)-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid 2-(3-methylimidazol-3-ium-1-yl)ethyl ester Formula: C19H22ClN4O3+ MolecularWeight: 389.85598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=CC=C(C=C2)Cl)C(=O)OCCN3C=C[N+](=C3)C

Isomeric SMILES

CC1=C(C(NC(=O)N1C)C2=CC=C(C=C2)Cl)C(=O)OCCN3C=C[N+](=C3)C

InChI

InChI=1S/C19H21ClN4O3/c1-13-16(18(25)27-11-10-24-9-8-22(2)12-24)17(21-19(26)23(13)3)14-4-6-15(20)7-5-14/h4-9,12,17H,10-11H2,1-3H3/p+1