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2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]propane-1,3-diol

2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]propane-1,3-diol

Systemtic Name:2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]propane-1,3-diol
Openeye Name:2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]propane-1,3-diol
CAS Name:2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-9-purinyl]propane-1,3-diol
IUPAC Name:2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]propane-1,3-diol
Traditional Name:2-[6-(homoveratrylamino)purin-9-yl]propane-1,3-diol
Formula: C18H23N5O4
MolecularWeight: 373.40632
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2N=CN3C(CO)CO)OC


Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2N=CN3C(CO)CO)OC


InChI

InChI=1S/C18H23N5O4/c1-26-14-4-3-12(7-15(14)27-2)5-6-19-17-16-18(21-10-20-17)23(11-22-16)13(8-24)9-25/h3-4,7,10-11,13,24-25H,5-6,8-9H2,1-2H3,(H,19,20,21)


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