[(1S,4R)-4-(2-azanyl-6-chloranyl-purin-9-yl)-3-methyl-cyclopent-2-en-1-yl]methyl methyl carbonate

Systemtic Name: [(1S,4R)-4-(2-azanyl-6-chloranyl-purin-9-yl)-3-methyl-cyclopent-2-en-1-yl]methyl methyl carbonate Openeye Name: [(1S,4R)-4-(2-amino-6-chloro-purin-9-yl)-3-methyl-cyclopent-2-en-1-yl]methyl methyl carbonate CAS Name: carbonic acid [(1S,4R)-4-(2-amino-6-chloro-9-purinyl)-3-methyl-1-cyclopent-2-enyl]methyl methyl ester IUPAC Name: [(1S,4R)-4-(2-amino-6-chloropurin-9-yl)-3-methylcyclopent-2-en-1-yl]methyl methyl carbonate Traditional Name: carbonic acid [(1S,4R)-4-(2-amino-6-chloro-purin-9-yl)-3-methyl-cyclopent-2-en-1-yl]methyl methyl ester Formula: C14H16ClN5O3 MolecularWeight: 337.76154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(CC1N2C=NC3=C2N=C(N=C3Cl)N)COC(=O)OC

Isomeric SMILES

CC1=C[C@H](C[C@H]1N2C=NC3=C2N=C(N=C3Cl)N)COC(=O)OC

InChI

InChI=1S/C14H16ClN5O3/c1-7-3-8(5-23-14(21)22-2)4-9(7)20-6-17-10-11(15)18-13(16)19-12(10)20/h3,6,8-9H,4-5H2,1-2H3,(H2,16,18,19)/t8-,9-/m1/s1