2-(4-chlorophenyl)-4-ethyl-6-(2-methylpropyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-4-ethyl-6-(2-methylpropyl)pyrimidine-5-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-4-ethyl-6-isobutyl-pyrimidine-5-carboxylic acid CAS Name: 2-(4-chlorophenyl)-4-ethyl-6-(2-methylpropyl)-5-pyrimidinecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-4-ethyl-6-(2-methylpropyl)pyrimidine-5-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-4-ethyl-6-isobutyl-pyrimidine-5-carboxylic acid Formula: C17H19ClN2O2 MolecularWeight: 318.79796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)CC(C)C)C(=O)O

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)CC(C)C)C(=O)O

InChI

InChI=1S/C17H19ClN2O2/c1-4-13-15(17(21)22)14(9-10(2)3)20-16(19-13)11-5-7-12(18)8-6-11/h5-8,10H,4,9H2,1-3H3,(H,21,22)