3-cyclopropyl-1-ethyl-7-[(4-methoxyphenyl)methyl]purine-2,6-dione

Systemtic Name: 3-cyclopropyl-1-ethyl-7-[(4-methoxyphenyl)methyl]purine-2,6-dione Openeye Name: 3-cyclopropyl-1-ethyl-7-[(4-methoxyphenyl)methyl]purine-2,6-dione CAS Name: 3-cyclopropyl-1-ethyl-7-[(4-methoxyphenyl)methyl]purine-2,6-dione IUPAC Name: 3-cyclopropyl-1-ethyl-7-[(4-methoxyphenyl)methyl]purine-2,6-dione Traditional Name: 3-cyclopropyl-1-ethyl-7-p-anisyl-xanthine Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=CN2CC3=CC=C(C=C3)OC)N(C1=O)C4CC4

Isomeric SMILES

CCN1C(=O)C2=C(N=CN2CC3=CC=C(C=C3)OC)N(C1=O)C4CC4

InChI

InChI=1S/C18H20N4O3/c1-3-21-17(23)15-16(22(18(21)24)13-6-7-13)19-11-20(15)10-12-4-8-14(25-2)9-5-12/h4-5,8-9,11,13H,3,6-7,10H2,1-2H3