N-[9-[(1-octoxy-3-phenylmethoxy-propan-2-yl)oxymethyl]-6-oxidanylidene-3H-purin-2-yl]ethanamide

Systemtic Name: N-[9-[(1-octoxy-3-phenylmethoxy-propan-2-yl)oxymethyl]-6-oxidanylidene-3H-purin-2-yl]ethanamide Openeye Name: N-[9-[[1-(benzyloxymethyl)-2-octoxy-ethoxy]methyl]-6-oxo-3H-purin-2-yl]acetamide CAS Name: N-[9-[(1-octoxy-3-phenylmethoxypropan-2-yl)oxymethyl]-6-oxo-3H-purin-2-yl]acetamide IUPAC Name: N-[9-[(1-octoxy-3-phenylmethoxypropan-2-yl)oxymethyl]-6-oxo-3H-purin-2-yl]acetamide Traditional Name: N-[9-[[1-(benzoxymethyl)-2-octoxy-ethoxy]methyl]-6-keto-3H-purin-2-yl]acetamide Formula: C26H37N5O5 MolecularWeight: 499.60248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(COCC1=CC=CC=C1)OCN2C=NC3=C2NC(=NC3=O)NC(=O)C

Isomeric SMILES

CCCCCCCCOCC(COCC1=CC=CC=C1)OCN2C=NC3=C2NC(=NC3=O)NC(=O)C

InChI

InChI=1S/C26H37N5O5/c1-3-4-5-6-7-11-14-34-16-22(17-35-15-21-12-9-8-10-13-21)36-19-31-18-27-23-24(31)29-26(28-20(2)32)30-25(23)33/h8-10,12-13,18,22H,3-7,11,14-17,19H2,1-2H3,(H2,28,29,30,32,33)