7-hexyl-3-methyl-8-(4-methylpiperidin-1-yl)purine-2,6-dione

Systemtic Name: 7-hexyl-3-methyl-8-(4-methylpiperidin-1-yl)purine-2,6-dione Openeye Name: 7-hexyl-3-methyl-8-(4-methyl-1-piperidyl)purine-2,6-dione CAS Name: 7-hexyl-3-methyl-8-(4-methyl-1-piperidinyl)purine-2,6-dione IUPAC Name: 7-hexyl-3-methyl-8-(4-methylpiperidin-1-yl)purine-2,6-dione Traditional Name: 7-hexyl-3-methyl-8-(4-methylpiperidino)xanthine Formula: C18H29N5O2 MolecularWeight: 347.45516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(N=C1N3CCC(CC3)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCN1C2=C(N=C1N3CCC(CC3)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C18H29N5O2/c1-4-5-6-7-10-23-14-15(21(3)18(25)20-16(14)24)19-17(23)22-11-8-13(2)9-12-22/h13H,4-12H2,1-3H3,(H,20,24,25)