N-[3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]ethanamide

Systemtic Name: N-[3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]ethanamide Openeye Name: N-[1-methyl-2-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]octyl]acetamide CAS Name: N-[3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]acetamide IUPAC Name: N-[3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]acetamide Traditional Name: N-[2-[6-keto-2-(2-propoxyphenyl)-3H-purin-9-yl]-1-methyl-octyl]acetamide Formula: C25H35N5O3 MolecularWeight: 453.5771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)NC(=O)C)N1C=NC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC

Isomeric SMILES

CCCCCCC(C(C)NC(=O)C)N1C=NC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC

InChI

InChI=1S/C25H35N5O3/c1-5-7-8-9-13-20(17(3)27-18(4)31)30-16-26-22-24(30)28-23(29-25(22)32)19-12-10-11-14-21(19)33-15-6-2/h10-12,14,16-17,20H,5-9,13,15H2,1-4H3,(H,27,31)(H,28,29,32)