[3-butyl-7-methyl-2,6-bis(oxidanylidene)purin-8-yl]methyl 2-(4-methoxyphenyl)ethanoate

Systemtic Name: [3-butyl-7-methyl-2,6-bis(oxidanylidene)purin-8-yl]methyl 2-(4-methoxyphenyl)ethanoate Openeye Name: (3-butyl-7-methyl-2,6-dioxo-purin-8-yl)methyl 2-(4-methoxyphenyl)acetate CAS Name: 2-(4-methoxyphenyl)acetic acid (3-butyl-7-methyl-2,6-dioxo-8-purinyl)methyl ester IUPAC Name: (3-butyl-7-methyl-2,6-dioxopurin-8-yl)methyl 2-(4-methoxyphenyl)acetate Traditional Name: 2-(4-methoxyphenyl)acetic acid (3-butyl-2,6-diketo-7-methyl-purin-8-yl)methyl ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)CC3=CC=C(C=C3)OC)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)CC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C20H24N4O5/c1-4-5-10-24-18-17(19(26)22-20(24)27)23(2)15(21-18)12-29-16(25)11-13-6-8-14(28-3)9-7-13/h6-9H,4-5,10-12H2,1-3H3,(H,22,26,27)