6-chloranyl-9-prop-2-ynyl-purine

Systemtic Name: 6-chloranyl-9-prop-2-ynyl-purine Openeye Name: 6-chloro-9-prop-2-ynyl-purine CAS Name: 6-chloro-9-prop-2-ynylpurine IUPAC Name: 6-chloro-9-prop-2-ynylpurine Traditional Name: 6-chloro-9-propargyl-purine Formula: C8H5ClN4 MolecularWeight: 192.6051

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=NC2=C1N=CN=C2Cl

Isomeric SMILES

C#CCN1C=NC2=C1N=CN=C2Cl

InChI

InChI=1S/C8H5ClN4/c1-2-3-13-5-12-6-7(9)10-4-11-8(6)13/h1,4-5H,3H2