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

Systemtic Name: 2-azanyl-9-[(1-hexoxy-3-oxidanyl-propan-2-yl)oxymethyl]-3H-purin-6-one Openeye Name: 2-amino-9-[[1-(hexoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[(1-hexoxy-3-hydroxypropan-2-yl)oxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1-hexoxy-3-hydroxypropan-2-yl)oxymethyl]-3H-purin-6-one Traditional Name: 2-amino-9-[[1-(hexoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one Formula: C15H25N5O4 MolecularWeight: 339.3901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC(CO)OCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CCCCCCOCC(CO)OCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C15H25N5O4/c1-2-3-4-5-6-23-8-11(7-21)24-10-20-9-17-12-13(20)18-15(16)19-14(12)22/h9,11,21H,2-8,10H2,1H3,(H3,16,18,19,22)