2-methyl-4-pentan-3-yloxy-6-[(2,4,6-trimethylphenyl)amino]pyrimidine-5-carboxylic acid

Systemtic Name: 2-methyl-4-pentan-3-yloxy-6-[(2,4,6-trimethylphenyl)amino]pyrimidine-5-carboxylic acid Openeye Name: 4-(1-ethylpropoxy)-2-methyl-6-(2,4,6-trimethylanilino)pyrimidine-5-carboxylic acid CAS Name: 2-methyl-4-pentan-3-yloxy-6-(2,4,6-trimethylanilino)-5-pyrimidinecarboxylic acid IUPAC Name: 2-methyl-4-pentan-3-yloxy-6-(2,4,6-trimethylanilino)pyrimidine-5-carboxylic acid Traditional Name: 4-(1-ethylpropoxy)-6-mesidino-2-methyl-pyrimidine-5-carboxylic acid Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=NC(=NC(=C1C(=O)O)NC2=C(C=C(C=C2C)C)C)C

Isomeric SMILES

CCC(CC)OC1=NC(=NC(=C1C(=O)O)NC2=C(C=C(C=C2C)C)C)C

InChI

InChI=1S/C20H27N3O3/c1-7-15(8-2)26-19-16(20(24)25)18(21-14(6)22-19)23-17-12(4)9-11(3)10-13(17)5/h9-10,15H,7-8H2,1-6H3,(H,24,25)(H,21,22,23)