methyl 2-[3-[[6-azanyl-8-oxidanylidene-2-(oxolan-2-ylmethoxy)-7H-purin-9-yl]methyl]phenyl]ethanoate

Systemtic Name: methyl 2-[3-[[6-azanyl-8-oxidanylidene-2-(oxolan-2-ylmethoxy)-7H-purin-9-yl]methyl]phenyl]ethanoate Openeye Name: methyl 2-[3-[[6-amino-8-oxo-2-(tetrahydrofuran-2-ylmethoxy)-7H-purin-9-yl]methyl]phenyl]acetate CAS Name: 2-[3-[[6-amino-8-oxo-2-(2-oxolanylmethoxy)-7H-purin-9-yl]methyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[[6-amino-8-oxo-2-(oxolan-2-ylmethoxy)-7H-purin-9-yl]methyl]phenyl]acetate Traditional Name: 2-[3-[[6-amino-8-keto-2-(tetrahydrofurfuryloxy)-7H-purin-9-yl]methyl]phenyl]acetic acid methyl ester Formula: C20H23N5O5 MolecularWeight: 413.42712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=CC=C1)CN2C3=C(C(=NC(=N3)OCC4CCCO4)N)NC2=O

Isomeric SMILES

COC(=O)CC1=CC(=CC=C1)CN2C3=C(C(=NC(=N3)OCC4CCCO4)N)NC2=O

InChI

InChI=1S/C20H23N5O5/c1-28-15(26)9-12-4-2-5-13(8-12)10-25-18-16(22-20(25)27)17(21)23-19(24-18)30-11-14-6-3-7-29-14/h2,4-5,8,14H,3,6-7,9-11H2,1H3,(H,22,27)(H2,21,23,24)