1-[4-(4-methoxyphenoxy)butyl]-3-methyl-7-propyl-purine-2,6-dione

Systemtic Name: 1-[4-(4-methoxyphenoxy)butyl]-3-methyl-7-propyl-purine-2,6-dione Openeye Name: 1-[4-(4-methoxyphenoxy)butyl]-3-methyl-7-propyl-purine-2,6-dione CAS Name: 1-[4-(4-methoxyphenoxy)butyl]-3-methyl-7-propylpurine-2,6-dione IUPAC Name: 1-[4-(4-methoxyphenoxy)butyl]-3-methyl-7-propylpurine-2,6-dione Traditional Name: 1-[4-(4-methoxyphenoxy)butyl]-3-methyl-7-propyl-xanthine Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCOC3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H26N4O4/c1-4-11-23-14-21-18-17(23)19(25)24(20(26)22(18)2)12-5-6-13-28-16-9-7-15(27-3)8-10-16/h7-10,14H,4-6,11-13H2,1-3H3