4-pentan-3-ylpyrimidine-5-carboxylate

Systemtic Name: 4-pentan-3-ylpyrimidine-5-carboxylate Openeye Name: 4-(1-ethylpropyl)pyrimidine-5-carboxylate CAS Name: 4-pentan-3-yl-5-pyrimidinecarboxylate IUPAC Name: 4-pentan-3-ylpyrimidine-5-carboxylate Traditional Name: 4-(1-ethylpropyl)pyrimidine-5-carboxylate Formula: C10H13N2O2- MolecularWeight: 193.22242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NC=NC=C1C(=O)[O-]

Isomeric SMILES

CCC(CC)C1=NC=NC=C1C(=O)[O-]

InChI

InChI=1S/C10H14N2O2/c1-3-7(4-2)9-8(10(13)14)5-11-6-12-9/h5-7H,3-4H2,1-2H3,(H,13,14)/p-1