3-(2-methyl-6-oxidanylidene-3H-purin-9-yl)nonan-2-yl ethanoate

Systemtic Name: 3-(2-methyl-6-oxidanylidene-3H-purin-9-yl)nonan-2-yl ethanoate Openeye Name: [1-methyl-2-(2-methyl-6-oxo-3H-purin-9-yl)octyl] acetate CAS Name: acetic acid 3-(2-methyl-6-oxo-3H-purin-9-yl)nonan-2-yl ester IUPAC Name: 3-(2-methyl-6-oxo-3H-purin-9-yl)nonan-2-yl acetate Traditional Name: acetic acid [2-(6-keto-2-methyl-3H-purin-9-yl)-1-methyl-octyl] ester Formula: C17H26N4O3 MolecularWeight: 334.41334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)OC(=O)C)N1C=NC2=C1NC(=NC2=O)C

Isomeric SMILES

CCCCCCC(C(C)OC(=O)C)N1C=NC2=C1NC(=NC2=O)C

InChI

InChI=1S/C17H26N4O3/c1-5-6-7-8-9-14(11(2)24-13(4)22)21-10-18-15-16(21)19-12(3)20-17(15)23/h10-11,14H,5-9H2,1-4H3,(H,19,20,23)