1-ethyl-3,8-bis(furan-2-ylmethyl)-7-methyl-purine-2,6-dione

Systemtic Name: 1-ethyl-3,8-bis(furan-2-ylmethyl)-7-methyl-purine-2,6-dione Openeye Name: 1-ethyl-3,8-bis(2-furylmethyl)-7-methyl-purine-2,6-dione CAS Name: 1-ethyl-3,8-bis(2-furanylmethyl)-7-methylpurine-2,6-dione IUPAC Name: 1-ethyl-3,8-bis(furan-2-ylmethyl)-7-methylpurine-2,6-dione Traditional Name: 1-ethyl-3,8-bis(2-furfuryl)-7-methyl-xanthine Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C(N2C)CC3=CC=CO3)N(C1=O)CC4=CC=CO4

Isomeric SMILES

CCN1C(=O)C2=C(N=C(N2C)CC3=CC=CO3)N(C1=O)CC4=CC=CO4

InChI

InChI=1S/C18H18N4O4/c1-3-21-17(23)15-16(22(18(21)24)11-13-7-5-9-26-13)19-14(20(15)2)10-12-6-4-8-25-12/h4-9H,3,10-11H2,1-2H3