ethyl 3-[6-(3-hydroxyphenyl)-2-morpholin-4-yl-purin-9-yl]propanoate

Systemtic Name: ethyl 3-[6-(3-hydroxyphenyl)-2-morpholin-4-yl-purin-9-yl]propanoate Openeye Name: ethyl 3-[6-(3-hydroxyphenyl)-2-morpholino-purin-9-yl]propanoate CAS Name: 3-[6-(3-hydroxyphenyl)-2-(4-morpholinyl)-9-purinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-(3-hydroxyphenyl)-2-morpholin-4-ylpurin-9-yl]propanoate Traditional Name: 3-[6-(3-hydroxyphenyl)-2-morpholino-purin-9-yl]propionic acid ethyl ester Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C=NC2=C(N=C(N=C21)N3CCOCC3)C4=CC(=CC=C4)O

Isomeric SMILES

CCOC(=O)CCN1C=NC2=C(N=C(N=C21)N3CCOCC3)C4=CC(=CC=C4)O

InChI

InChI=1S/C20H23N5O4/c1-2-29-16(27)6-7-25-13-21-18-17(14-4-3-5-15(26)12-14)22-20(23-19(18)25)24-8-10-28-11-9-24/h3-5,12-13,26H,2,6-11H2,1H3