7-(2-ethoxyethyl)-8-[[(2S)-2-ethylpiperidin-1-yl]methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(2-ethoxyethyl)-8-[[(2S)-2-ethylpiperidin-1-yl]methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(2-ethoxyethyl)-8-[[(2S)-2-ethyl-1-piperidyl]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(2-ethoxyethyl)-8-[[(2S)-2-ethyl-1-piperidinyl]methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(2-ethoxyethyl)-8-[[(2S)-2-ethylpiperidin-1-yl]methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-ethoxyethyl)-8-[[(2S)-2-ethylpiperidino]methyl]-1,3-dimethyl-xanthine Formula: C19H31N5O3 MolecularWeight: 377.48114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC2=NC3=C(N2CCOCC)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC[C@H]1CCCCN1CC2=NC3=C(N2CCOCC)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C19H31N5O3/c1-5-14-9-7-8-10-23(14)13-15-20-17-16(24(15)11-12-27-6-2)18(25)22(4)19(26)21(17)3/h14H,5-13H2,1-4H3/t14-/m0/s1