2-phenyl-4-propyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-phenyl-4-propyl-pyrimidine-5-carboxylic acid Openeye Name: 2-phenyl-4-propyl-pyrimidine-5-carboxylic acid CAS Name: 2-phenyl-4-propyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-phenyl-4-propylpyrimidine-5-carboxylic acid Traditional Name: 2-phenyl-4-propyl-pyrimidine-5-carboxylic acid Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O2/c1-2-6-12-11(14(17)18)9-15-13(16-12)10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3,(H,17,18)