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

Systemtic Name: 8-azanyl-9-[(1-oxidanyl-3-pentoxy-propan-2-yl)oxymethyl]-3H-purin-6-one Openeye Name: 8-amino-9-[[1-(hydroxymethyl)-2-pentoxy-ethoxy]methyl]-3H-purin-6-one CAS Name: 8-amino-9-[(1-hydroxy-3-pentoxypropan-2-yl)oxymethyl]-3H-purin-6-one IUPAC Name: 8-amino-9-[(1-hydroxy-3-pentoxypropan-2-yl)oxymethyl]-3H-purin-6-one Traditional Name: 8-amino-9-[[1-(amoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one Formula: C14H23N5O4 MolecularWeight: 325.36352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCC(CO)OCN1C2=C(C(=O)N=CN2)N=C1N

Isomeric SMILES

CCCCCOCC(CO)OCN1C2=C(C(=O)N=CN2)N=C1N

InChI

InChI=1S/C14H23N5O4/c1-2-3-4-5-22-7-10(6-20)23-9-19-12-11(18-14(19)15)13(21)17-8-16-12/h8,10,20H,2-7,9H2,1H3,(H2,15,18)(H,16,17,21)