7-(2-ethoxyphenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 7-(2-ethoxyphenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 7-(2-ethoxyphenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione CAS Name: 7-(2-ethoxyphenyl)-1,3-dimethyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-(2-ethoxyphenyl)-1,3-dimethyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 1,3-dimethyl-7-o-phenetyl-8-piperazino-xanthine Formula: C19H24N6O3 MolecularWeight: 384.43226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C3=C(N=C2N4CCNCC4)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C3=C(N=C2N4CCNCC4)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C19H24N6O3/c1-4-28-14-8-6-5-7-13(14)25-15-16(22(2)19(27)23(3)17(15)26)21-18(25)24-11-9-20-10-12-24/h5-8,20H,4,9-12H2,1-3H3