[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-(hydroxymethyl)cyclobutyl]methyl 1-methyl-4H-pyridine-3-carboxylate

Systemtic Name: [2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-(hydroxymethyl)cyclobutyl]methyl 1-methyl-4H-pyridine-3-carboxylate Openeye Name: [2-(2-amino-6-oxo-3H-purin-9-yl)-4-(hydroxymethyl)cyclobutyl]methyl 1-methyl-4H-pyridine-3-carboxylate CAS Name: 1-methyl-4H-pyridine-3-carboxylic acid [2-(2-amino-6-oxo-3H-purin-9-yl)-4-(hydroxymethyl)cyclobutyl]methyl ester IUPAC Name: [2-(2-amino-6-oxo-3H-purin-9-yl)-4-(hydroxymethyl)cyclobutyl]methyl 1-methyl-4H-pyridine-3-carboxylate Traditional Name: 1-methyl-4H-pyridine-3-carboxylic acid [2-(2-amino-6-keto-3H-purin-9-yl)-4-methylol-cyclobutyl]methyl ester Formula: C18H22N6O4 MolecularWeight: 386.40508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CCC(=C1)C(=O)OCC2C(CC2N3C=NC4=C3NC(=NC4=O)N)CO

Isomeric SMILES

CN1C=CCC(=C1)C(=O)OCC2C(CC2N3C=NC4=C3NC(=NC4=O)N)CO

InChI

InChI=1S/C18H22N6O4/c1-23-4-2-3-10(6-23)17(27)28-8-12-11(7-25)5-13(12)24-9-20-14-15(24)21-18(19)22-16(14)26/h2,4,6,9,11-13,25H,3,5,7-8H2,1H3,(H3,19,21,22,26)