[5-(2-azanyl-6-chloranyl-purin-9-yl)-3-azido-oxolan-2-yl]methyl ethanoate

Systemtic Name: [5-(2-azanyl-6-chloranyl-purin-9-yl)-3-azido-oxolan-2-yl]methyl ethanoate Openeye Name: [5-(2-amino-6-chloro-purin-9-yl)-3-azido-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [5-(2-amino-6-chloro-9-purinyl)-3-azido-2-oxolanyl]methyl ester IUPAC Name: [5-(2-amino-6-chloropurin-9-yl)-3-azidooxolan-2-yl]methyl acetate Traditional Name: acetic acid [5-(2-amino-6-chloro-purin-9-yl)-3-azido-tetrahydrofuran-2-yl]methyl ester Formula: C12H13ClN8O3 MolecularWeight: 352.73642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(CC(O1)N2C=NC3=C2N=C(N=C3Cl)N)N=[N+]=[N-]

Isomeric SMILES

CC(=O)OCC1C(CC(O1)N2C=NC3=C2N=C(N=C3Cl)N)N=[N+]=[N-]

InChI

InChI=1S/C12H13ClN8O3/c1-5(22)23-3-7-6(19-20-15)2-8(24-7)21-4-16-9-10(13)17-12(14)18-11(9)21/h4,6-8H,2-3H2,1H3,(H2,14,17,18)