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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC=C3Cl)CCOC

Isomeric SMILES

CC(C)N1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC=C3Cl)CCOC

InChI

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