4-chloranyl-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: 4-chloranyl-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carboxylate Openeye Name: 4-chloro-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-chloro-7-methyl-5-pyrrolo[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-chloro-7-methylpyrrolo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-chloro-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carboxylate Formula: C8H5ClN3O2- MolecularWeight: 210.5972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1N=CN=C2Cl)C(=O)[O-]

Isomeric SMILES

CN1C=C(C2=C1N=CN=C2Cl)C(=O)[O-]

InChI

InChI=1S/C8H6ClN3O2/c1-12-2-4(8(13)14)5-6(9)10-3-11-7(5)12/h2-3H,1H3,(H,13,14)/p-1