2-heptoxypyrimidine-5-carboxylic acid

Systemtic Name: 2-heptoxypyrimidine-5-carboxylic acid Openeye Name: 2-heptoxypyrimidine-5-carboxylic acid CAS Name: 2-heptoxy-5-pyrimidinecarboxylic acid IUPAC Name: 2-heptoxypyrimidine-5-carboxylic acid Traditional Name: 2-heptoxypyrimidine-5-carboxylic acid Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O3/c1-2-3-4-5-6-7-17-12-13-8-10(9-14-12)11(15)16/h8-9H,2-7H2,1H3,(H,15,16)