4-(2-chlorophenyl)-2-propan-2-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(2-chlorophenyl)-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-(2-chlorophenyl)-2-isopropyl-pyrimidine-5-carboxylic acid CAS Name: 4-(2-chlorophenyl)-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-(2-chlorophenyl)-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-(2-chlorophenyl)-2-isopropyl-pyrimidine-5-carboxylic acid Formula: C14H13ClN2O2 MolecularWeight: 276.71822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(C(=N1)C2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC(C)C1=NC=C(C(=N1)C2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C14H13ClN2O2/c1-8(2)13-16-7-10(14(18)19)12(17-13)9-5-3-4-6-11(9)15/h3-8H,1-2H3,(H,18,19)