3-[acetyloxy-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]propyl ethanoate; benzene

Systemtic Name: 3-[acetyloxy-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]propyl ethanoate; benzene Openeye Name: 3-[acetoxy-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]propyl acetate; benzene CAS Name: acetic acid 3-[acetyloxy-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]propyl ester; benzene IUPAC Name: 3-[acetyloxy-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]propyl acetate; benzene Traditional Name: acetic acid 3-[acetoxy-(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)methoxy]propyl ester; benzene Formula: C19H25N5O6 MolecularWeight: 419.4317

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCOC(N1CNC2=C1NC(=NC2=O)N)OC(=O)C.C1=CC=CC=C1

Isomeric SMILES

CC(=O)OCCCOC(N1CNC2=C1NC(=NC2=O)N)OC(=O)C.C1=CC=CC=C1

InChI

InChI=1S/C13H19N5O6.C6H6/c1-7(19)22-4-3-5-23-13(24-8(2)20)18-6-15-9-10(18)16-12(14)17-11(9)21;1-2-4-6-5-3-1/h13,15H,3-6H2,1-2H3,(H3,14,16,17,21);1-6H