[5-[8-chloranyl-6-(oxolan-3-ylamino)purin-9-yl]-4-ethoxy-3-ethylperoxy-oxolan-2-yl]methyl ethanoate

Systemtic Name: [5-[8-chloranyl-6-(oxolan-3-ylamino)purin-9-yl]-4-ethoxy-3-ethylperoxy-oxolan-2-yl]methyl ethanoate Openeye Name: [5-[8-chloro-6-(tetrahydrofuran-3-ylamino)purin-9-yl]-4-ethoxy-3-ethylperoxy-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [5-[8-chloro-6-(3-oxolanylamino)-9-purinyl]-4-ethoxy-3-ethyldioxy-2-oxolanyl]methyl ester IUPAC Name: [5-[8-chloro-6-(oxolan-3-ylamino)purin-9-yl]-4-ethoxy-3-ethylperoxyoxolan-2-yl]methyl acetate Traditional Name: acetic acid [5-[8-chloro-6-(tetrahydrofuran-3-ylamino)purin-9-yl]-4-ethoxy-3-ethylperoxy-tetrahydrofuran-2-yl]methyl ester Formula: C20H28ClN5O7 MolecularWeight: 485.91862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(C(OC1N2C3=C(C(=NC=N3)NC4CCOC4)N=C2Cl)COC(=O)C)OOCC

Isomeric SMILES

CCOC1C(C(OC1N2C3=C(C(=NC=N3)NC4CCOC4)N=C2Cl)COC(=O)C)OOCC

InChI

InChI=1S/C20H28ClN5O7/c1-4-29-16-15(33-31-5-2)13(9-30-11(3)27)32-19(16)26-18-14(25-20(26)21)17(22-10-23-18)24-12-6-7-28-8-12/h10,12-13,15-16,19H,4-9H2,1-3H3,(H,22,23,24)