4-(6-aminopurin-9-yl)buta-2,3-dienyl ethanoate

Systemtic Name: 4-(6-aminopurin-9-yl)buta-2,3-dienyl ethanoate Openeye Name: 4-(6-aminopurin-9-yl)buta-2,3-dienyl acetate CAS Name: acetic acid 4-(6-aminopurin-9-yl)buta-2,3-dienyl ester IUPAC Name: 4-(6-aminopurin-9-yl)buta-2,3-dienyl acetate Traditional Name: acetic acid 4-adenin-9-ylbuta-2,3-dienyl ester Formula: C11H11N5O2 MolecularWeight: 245.23734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC=C=CN1C=NC2=C1N=CN=C2N

Isomeric SMILES

CC(=O)OCC=C=CN1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C11H11N5O2/c1-8(17)18-5-3-2-4-16-7-15-9-10(12)13-6-14-11(9)16/h3-4,6-7H,5H2,1H3,(H2,12,13,14)