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methyl 2-[4-[(6-azanyl-2-butoxy-purin-9-yl)methyl]phenyl]ethanoate

methyl 2-[4-[(6-azanyl-2-butoxy-purin-9-yl)methyl]phenyl]ethanoate

Systemtic Name:methyl 2-[4-[(6-azanyl-2-butoxy-purin-9-yl)methyl]phenyl]ethanoate
Openeye Name:methyl 2-[4-[(6-amino-2-butoxy-purin-9-yl)methyl]phenyl]acetate
CAS Name:2-[4-[(6-amino-2-butoxy-9-purinyl)methyl]phenyl]acetic acid methyl ester
IUPAC Name:methyl 2-[4-[(6-amino-2-butoxypurin-9-yl)methyl]phenyl]acetate
Traditional Name:2-[4-[(6-amino-2-butoxy-purin-9-yl)methyl]phenyl]acetic acid methyl ester
Formula: C19H23N5O3
MolecularWeight: 369.41762
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CC=C(C=C3)CC(=O)OC


Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CC=C(C=C3)CC(=O)OC


InChI

InChI=1S/C19H23N5O3/c1-3-4-9-27-19-22-17(20)16-18(23-19)24(12-21-16)11-14-7-5-13(6-8-14)10-15(25)26-2/h5-8,12H,3-4,9-11H2,1-2H3,(H2,20,22,23)


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