2,8-bis(azanyl)-9-[(1-hexoxy-3-oxidanyl-propan-2-yl)oxymethyl]-3H-purin-6-one

Systemtic Name: 2,8-bis(azanyl)-9-[(1-hexoxy-3-oxidanyl-propan-2-yl)oxymethyl]-3H-purin-6-one Openeye Name: 2,8-diamino-9-[[1-(hexoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one CAS Name: 2,8-diamino-9-[(1-hexoxy-3-hydroxypropan-2-yl)oxymethyl]-3H-purin-6-one IUPAC Name: 2,8-diamino-9-[(1-hexoxy-3-hydroxypropan-2-yl)oxymethyl]-3H-purin-6-one Traditional Name: 2,8-diamino-9-[[1-(hexoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one Formula: C15H26N6O4 MolecularWeight: 354.40474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N6O4/c1-2-3-4-5-6-24-8-10(7-22)25-9-21-12-11(18-15(21)17)13(23)20-14(16)19-12/h10,22H,2-9H2,1H3,(H2,17,18)(H3,16,19,20,23)