[(1R,4S)-4-(6-azanylpurin-3-yl)cyclopent-2-en-1-yl] ethanoate

Systemtic Name: [(1R,4S)-4-(6-azanylpurin-3-yl)cyclopent-2-en-1-yl] ethanoate Openeye Name: [(1R,4S)-4-(6-aminopurin-3-yl)cyclopent-2-en-1-yl] acetate CAS Name: acetic acid [(1R,4S)-4-(6-amino-3-purinyl)-1-cyclopent-2-enyl] ester IUPAC Name: [(1R,4S)-4-(6-aminopurin-3-yl)cyclopent-2-en-1-yl] acetate Traditional Name: acetic acid [(1R,4S)-4-(6-aminopurin-3-yl)cyclopent-2-en-1-yl] ester Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C=C1)N2C=NC(=C3C2=NC=N3)N

Isomeric SMILES

CC(=O)O[C@@H]1C[C@@H](C=C1)N2C=NC(=C3C2=NC=N3)N

InChI

InChI=1S/C12H13N5O2/c1-7(18)19-9-3-2-8(4-9)17-6-16-11(13)10-12(17)15-5-14-10/h2-3,5-6,8-9H,4,13H2,1H3/t8-,9+/m1/s1