2-heptoxy-4-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-heptoxy-4-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-heptoxy-4-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-heptoxy-4-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-heptoxy-4-methylpyrimidine-5-carboxylic acid Traditional Name: 2-heptoxy-4-methyl-pyrimidine-5-carboxylic acid Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=NC=C(C(=N1)C)C(=O)O

Isomeric SMILES

CCCCCCCOC1=NC=C(C(=N1)C)C(=O)O

InChI

InChI=1S/C13H20N2O3/c1-3-4-5-6-7-8-18-13-14-9-11(12(16)17)10(2)15-13/h9H,3-8H2,1-2H3,(H,16,17)