[5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]methyl hexanoate

Systemtic Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]methyl hexanoate Openeye Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl hexanoate CAS Name: hexanoic acid [5-[6-(cyclopropylmethylamino)-9-purinyl]-2-oxolanyl]methyl ester IUPAC Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]methyl hexanoate Traditional Name: hexanoic acid [5-[6-(cyclopropylmethylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl ester Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC1CCC(O1)N2C=NC3=C2N=CN=C3NCC4CC4

Isomeric SMILES

CCCCCC(=O)OCC1CCC(O1)N2C=NC3=C2N=CN=C3NCC4CC4

InChI

InChI=1S/C20H29N5O3/c1-2-3-4-5-17(26)27-11-15-8-9-16(28-15)25-13-24-18-19(21-10-14-6-7-14)22-12-23-20(18)25/h12-16H,2-11H2,1H3,(H,21,22,23)