8-(heptoxymethyl)-1-methyl-2-(2-phenylmethoxyethoxy)-7H-purin-6-one

Systemtic Name: 8-(heptoxymethyl)-1-methyl-2-(2-phenylmethoxyethoxy)-7H-purin-6-one Openeye Name: 2-(2-benzyloxyethoxy)-8-(heptoxymethyl)-1-methyl-7H-purin-6-one CAS Name: 8-(heptoxymethyl)-1-methyl-2-(2-phenylmethoxyethoxy)-7H-purin-6-one IUPAC Name: 8-(heptoxymethyl)-1-methyl-2-(2-phenylmethoxyethoxy)-7H-purin-6-one Traditional Name: 2-(2-benzoxyethoxy)-8-(heptoxymethyl)-1-methyl-7H-purin-6-one Formula: C23H32N4O4 MolecularWeight: 428.52458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCC1=NC2=C(N1)C(=O)N(C(=N2)OCCOCC3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCOCC1=NC2=C(N1)C(=O)N(C(=N2)OCCOCC3=CC=CC=C3)C

InChI

InChI=1S/C23H32N4O4/c1-3-4-5-6-10-13-29-17-19-24-20-21(25-19)26-23(27(2)22(20)28)31-15-14-30-16-18-11-8-7-9-12-18/h7-9,11-12H,3-6,10,13-17H2,1-2H3,(H,24,25)