[(1R,4S)-4-(2-azanyl-6-chloranyl-purin-9-yl)cyclopent-2-en-1-yl] hydrogen carbonate

Systemtic Name: [(1R,4S)-4-(2-azanyl-6-chloranyl-purin-9-yl)cyclopent-2-en-1-yl] hydrogen carbonate Openeye Name: [(1R,4S)-4-(2-amino-6-chloro-purin-9-yl)cyclopent-2-en-1-yl] hydrogen carbonate CAS Name: carbonic acid [(1R,4S)-4-(2-amino-6-chloro-9-purinyl)-1-cyclopent-2-enyl] ester IUPAC Name: [(1R,4S)-4-(2-amino-6-chloropurin-9-yl)cyclopent-2-en-1-yl] hydrogen carbonate Traditional Name: carbonic acid [(1R,4S)-4-(2-amino-6-chloro-purin-9-yl)cyclopent-2-en-1-yl] ester Formula: C11H10ClN5O3 MolecularWeight: 295.6818

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1OC(=O)O)N2C=NC3=C2N=C(N=C3Cl)N

Isomeric SMILES

C1[C@@H](C=C[C@@H]1OC(=O)O)N2C=NC3=C2N=C(N=C3Cl)N

InChI

InChI=1S/C11H10ClN5O3/c12-8-7-9(16-10(13)15-8)17(4-14-7)5-1-2-6(3-5)20-11(18)19/h1-2,4-6H,3H2,(H,18,19)(H2,13,15,16)/t5-,6+/m1/s1