3-(6-azanyl-8-bromanyl-purin-9-yl)propyl ethanoate

Systemtic Name: 3-(6-azanyl-8-bromanyl-purin-9-yl)propyl ethanoate Openeye Name: 3-(6-amino-8-bromo-purin-9-yl)propyl acetate CAS Name: acetic acid 3-(6-amino-8-bromo-9-purinyl)propyl ester IUPAC Name: 3-(6-amino-8-bromopurin-9-yl)propyl acetate Traditional Name: acetic acid 3-(6-amino-8-bromo-purin-9-yl)propyl ester Formula: C10H12BrN5O2 MolecularWeight: 314.13858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCN1C2=C(C(=NC=N2)N)N=C1Br

Isomeric SMILES

CC(=O)OCCCN1C2=C(C(=NC=N2)N)N=C1Br

InChI

InChI=1S/C10H12BrN5O2/c1-6(17)18-4-2-3-16-9-7(15-10(16)11)8(12)13-5-14-9/h5H,2-4H2,1H3,(H2,12,13,14)