9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione

Systemtic Name: 9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione Openeye Name: 9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione CAS Name: 9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione IUPAC Name: 9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione Traditional Name: 9-homoveratryl-1-methyl-6,7-dihydropurino[7,8-a]pyrimidine-2,4,8-trione Formula: C19H21N5O5 MolecularWeight: 399.40054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3CCC(=O)N(C3=N2)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3CCC(=O)N(C3=N2)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C19H21N5O5/c1-22-16-15(17(26)21-19(22)27)24-9-7-14(25)23(18(24)20-16)8-6-11-4-5-12(28-2)13(10-11)29-3/h4-5,10H,6-9H2,1-3H3,(H,21,26,27)