methyl 5-[[1-cyclopentyl-3-(3-methoxyphenyl)-2,6-bis(oxidanylidene)purin-7-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[1-cyclopentyl-3-(3-methoxyphenyl)-2,6-bis(oxidanylidene)purin-7-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[1-cyclopentyl-3-(3-methoxyphenyl)-2,6-dioxo-purin-7-yl]methyl]furan-2-carboxylate CAS Name: 5-[[1-cyclopentyl-3-(3-methoxyphenyl)-2,6-dioxo-7-purinyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[1-cyclopentyl-3-(3-methoxyphenyl)-2,6-dioxopurin-7-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[1-cyclopentyl-2,6-diketo-3-(3-methoxyphenyl)purin-7-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C24H24N4O6 MolecularWeight: 464.47056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=C(C(=O)N(C2=O)C4CCCC4)N(C=N3)CC5=CC=C(O5)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=C(C(=O)N(C2=O)C4CCCC4)N(C=N3)CC5=CC=C(O5)C(=O)OC

InChI

InChI=1S/C24H24N4O6/c1-32-17-9-5-8-16(12-17)27-21-20(22(29)28(24(27)31)15-6-3-4-7-15)26(14-25-21)13-18-10-11-19(34-18)23(30)33-2/h5,8-12,14-15H,3-4,6-7,13H2,1-2H3