3-methyl-8-[(3R)-3-methylpiperidin-1-yl]-7-propyl-purine-2,6-dione

Systemtic Name: 3-methyl-8-[(3R)-3-methylpiperidin-1-yl]-7-propyl-purine-2,6-dione Openeye Name: 3-methyl-8-[(3R)-3-methyl-1-piperidyl]-7-propyl-purine-2,6-dione CAS Name: 3-methyl-8-[(3R)-3-methyl-1-piperidinyl]-7-propylpurine-2,6-dione IUPAC Name: 3-methyl-8-[(3R)-3-methylpiperidin-1-yl]-7-propylpurine-2,6-dione Traditional Name: 3-methyl-8-[(3R)-3-methylpiperidino]-7-propyl-xanthine Formula: C15H23N5O2 MolecularWeight: 305.37542

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1N3CCCC(C3)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCCN1C2=C(N=C1N3CCC[C@H](C3)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C15H23N5O2/c1-4-7-20-11-12(18(3)15(22)17-13(11)21)16-14(20)19-8-5-6-10(2)9-19/h10H,4-9H2,1-3H3,(H,17,21,22)/t10-/m1/s1