[(1R,2S,4R)-2-acetyloxy-4-(2-azanyl-6-chloranyl-purin-9-yl)cyclopentyl]methyl ethanoate

Systemtic Name: [(1R,2S,4R)-2-acetyloxy-4-(2-azanyl-6-chloranyl-purin-9-yl)cyclopentyl]methyl ethanoate Openeye Name: [(1R,2S,4R)-2-acetoxy-4-(2-amino-6-chloro-purin-9-yl)cyclopentyl]methyl acetate CAS Name: acetic acid [(1R,2S,4R)-2-acetyloxy-4-(2-amino-6-chloro-9-purinyl)cyclopentyl]methyl ester IUPAC Name: [(1R,2S,4R)-2-acetyloxy-4-(2-amino-6-chloropurin-9-yl)cyclopentyl]methyl acetate Traditional Name: acetic acid [(1R,2S,4R)-2-acetoxy-4-(2-amino-6-chloro-purin-9-yl)cyclopentyl]methyl ester Formula: C15H18ClN5O4 MolecularWeight: 367.78752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC(CC1OC(=O)C)N2C=NC3=C2N=C(N=C3Cl)N

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN5O4/c1-7(22)24-5-9-3-10(4-11(9)25-8(2)23)21-6-18-12-13(16)19-15(17)20-14(12)21/h6,9-11H,3-5H2,1-2H3,(H2,17,19,20)/t9-,10-,11+/m1/s1