8-(4-methoxyphenyl)-1-methyl-9-propyl-3H-purine-2,6-dione

Systemtic Name: 8-(4-methoxyphenyl)-1-methyl-9-propyl-3H-purine-2,6-dione Openeye Name: 8-(4-methoxyphenyl)-1-methyl-9-propyl-3H-purine-2,6-dione CAS Name: 8-(4-methoxyphenyl)-1-methyl-9-propyl-3H-purine-2,6-dione IUPAC Name: 8-(4-methoxyphenyl)-1-methyl-9-propyl-3H-purine-2,6-dione Traditional Name: 8-(4-methoxyphenyl)-1-methyl-9-propyl-xanthine Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C(=O)N2)C)N=C1C3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C(=O)N2)C)N=C1C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H18N4O3/c1-4-9-20-13(10-5-7-11(23-3)8-6-10)17-12-14(20)18-16(22)19(2)15(12)21/h5-8H,4,9H2,1-3H3,(H,18,22)