[(1S,4R)-4-(6-chloranylpurin-9-yl)cyclopent-2-en-1-yl] ethanoate

Systemtic Name: [(1S,4R)-4-(6-chloranylpurin-9-yl)cyclopent-2-en-1-yl] ethanoate Openeye Name: [(1S,4R)-4-(6-chloropurin-9-yl)cyclopent-2-en-1-yl] acetate CAS Name: acetic acid [(1S,4R)-4-(6-chloro-9-purinyl)-1-cyclopent-2-enyl] ester IUPAC Name: [(1S,4R)-4-(6-chloropurin-9-yl)cyclopent-2-en-1-yl] acetate Traditional Name: acetic acid [(1S,4R)-4-(6-chloropurin-9-yl)cyclopent-2-en-1-yl] ester Formula: C12H11ClN4O2 MolecularWeight: 278.69434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C=C1)N2C=NC3=C2N=CN=C3Cl

Isomeric SMILES

CC(=O)O[C@H]1C[C@H](C=C1)N2C=NC3=C2N=CN=C3Cl

InChI

InChI=1S/C12H11ClN4O2/c1-7(18)19-9-3-2-8(4-9)17-6-16-10-11(13)14-5-15-12(10)17/h2-3,5-6,8-9H,4H2,1H3/t8-,9+/m0/s1