3-butyl-7-(2-methoxyethyl)purine-2,6-dione

Systemtic Name: 3-butyl-7-(2-methoxyethyl)purine-2,6-dione Openeye Name: 3-butyl-7-(2-methoxyethyl)purine-2,6-dione CAS Name: 3-butyl-7-(2-methoxyethyl)purine-2,6-dione IUPAC Name: 3-butyl-7-(2-methoxyethyl)purine-2,6-dione Traditional Name: 3-butyl-7-(2-methoxyethyl)xanthine Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C=N2)CCOC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C=N2)CCOC

InChI

InChI=1S/C12H18N4O3/c1-3-4-5-16-10-9(11(17)14-12(16)18)15(8-13-10)6-7-19-2/h8H,3-7H2,1-2H3,(H,14,17,18)