2,8-bis(azanyl)-9-(1-oxidanyldecan-2-yloxymethyl)-3H-purin-6-one

Systemtic Name: 2,8-bis(azanyl)-9-(1-oxidanyldecan-2-yloxymethyl)-3H-purin-6-one Openeye Name: 2,8-diamino-9-[1-(hydroxymethyl)nonoxymethyl]-3H-purin-6-one CAS Name: 2,8-diamino-9-(1-hydroxydecan-2-yloxymethyl)-3H-purin-6-one IUPAC Name: 2,8-diamino-9-(1-hydroxydecan-2-yloxymethyl)-3H-purin-6-one Traditional Name: 2,8-diamino-9-(1-methylolnonoxymethyl)-3H-purin-6-one Formula: C16H28N6O3 MolecularWeight: 352.43192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CO)OCN1C2=C(C(=O)N=C(N2)N)N=C1N

Isomeric SMILES

CCCCCCCCC(CO)OCN1C2=C(C(=O)N=C(N2)N)N=C1N

InChI

InChI=1S/C16H28N6O3/c1-2-3-4-5-6-7-8-11(9-23)25-10-22-13-12(19-16(22)18)14(24)21-15(17)20-13/h11,23H,2-10H2,1H3,(H2,18,19)(H3,17,20,21,24)