3-(2-chlorophenyl)-1-(2-methoxyethyl)-7-propyl-purine-2,6-dione

Systemtic Name: 3-(2-chlorophenyl)-1-(2-methoxyethyl)-7-propyl-purine-2,6-dione Openeye Name: 3-(2-chlorophenyl)-1-(2-methoxyethyl)-7-propyl-purine-2,6-dione CAS Name: 3-(2-chlorophenyl)-1-(2-methoxyethyl)-7-propylpurine-2,6-dione IUPAC Name: 3-(2-chlorophenyl)-1-(2-methoxyethyl)-7-propylpurine-2,6-dione Traditional Name: 3-(2-chlorophenyl)-1-(2-methoxyethyl)-7-propyl-xanthine Formula: C17H19ClN4O3 MolecularWeight: 362.81076

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC=C3Cl)CCOC

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC=C3Cl)CCOC

InChI

InChI=1S/C17H19ClN4O3/c1-3-8-20-11-19-15-14(20)16(23)21(9-10-25-2)17(24)22(15)13-7-5-4-6-12(13)18/h4-7,11H,3,8-10H2,1-2H3