2-(butylamino)-5-chloranyl-pyrimidine-4-carboxylate

Systemtic Name: 2-(butylamino)-5-chloranyl-pyrimidine-4-carboxylate Openeye Name: 2-(butylamino)-5-chloro-pyrimidine-4-carboxylate CAS Name: 2-(butylamino)-5-chloro-4-pyrimidinecarboxylate IUPAC Name: 2-(butylamino)-5-chloropyrimidine-4-carboxylate Traditional Name: 2-(butylamino)-5-chloro-pyrimidine-4-carboxylate Formula: C9H11ClN3O2- MolecularWeight: 228.65554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=C(C(=N1)C(=O)[O-])Cl

Isomeric SMILES

CCCCNC1=NC=C(C(=N1)C(=O)[O-])Cl

InChI

InChI=1S/C9H12ClN3O2/c1-2-3-4-11-9-12-5-6(10)7(13-9)8(14)15/h5H,2-4H2,1H3,(H,14,15)(H,11,12,13)/p-1