propan-2-yl 2-[4-[1,3-diethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenoxy]ethanoate

Systemtic Name: propan-2-yl 2-[4-[1,3-diethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenoxy]ethanoate Openeye Name: isopropyl 2-[4-(1,3-diethyl-2,6-dioxo-7H-purin-8-yl)phenoxy]acetate CAS Name: 2-[4-(1,3-diethyl-2,6-dioxo-7H-purin-8-yl)phenoxy]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-(1,3-diethyl-2,6-dioxo-7H-purin-8-yl)phenoxy]acetate Traditional Name: 2-[4-(1,3-diethyl-2,6-diketo-7H-purin-8-yl)phenoxy]acetic acid isopropyl ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)C3=CC=C(C=C3)OCC(=O)OC(C)C

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)C3=CC=C(C=C3)OCC(=O)OC(C)C

InChI

InChI=1S/C20H24N4O5/c1-5-23-18-16(19(26)24(6-2)20(23)27)21-17(22-18)13-7-9-14(10-8-13)28-11-15(25)29-12(3)4/h7-10,12H,5-6,11H2,1-4H3,(H,21,22)