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2-[3,5-dimethyl-4-(9-methylpurin-6-yl)piperazin-1-yl]ethanoate

2-[3,5-dimethyl-4-(9-methylpurin-6-yl)piperazin-1-yl]ethanoate

Systemtic Name:2-[3,5-dimethyl-4-(9-methylpurin-6-yl)piperazin-1-yl]ethanoate
Openeye Name:2-[3,5-dimethyl-4-(9-methylpurin-6-yl)piperazin-1-yl]acetate
CAS Name:2-[3,5-dimethyl-4-(9-methyl-6-purinyl)-1-piperazinyl]acetate
IUPAC Name:2-[3,5-dimethyl-4-(9-methylpurin-6-yl)piperazin-1-yl]acetate
Traditional Name:2-[3,5-dimethyl-4-(9-methylpurin-6-yl)piperazino]acetate
Formula: C14H19N6O2-
MolecularWeight: 303.33966
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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C2=NC=NC3=C2N=CN3C)C)CC(=O)[O-]


Isomeric SMILES

CC1CN(CC(N1C2=NC=NC3=C2N=CN3C)C)CC(=O)[O-]


InChI

InChI=1S/C14H20N6O2/c1-9-4-19(6-11(21)22)5-10(2)20(9)14-12-13(15-7-16-14)18(3)8-17-12/h7-10H,4-6H2,1-3H3,(H,21,22)/p-1


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