3-methyl-8-(2-methylpiperidin-1-yl)-7-(2-methylprop-2-enyl)purine-2,6-dione

Systemtic Name: 3-methyl-8-(2-methylpiperidin-1-yl)-7-(2-methylprop-2-enyl)purine-2,6-dione Openeye Name: 3-methyl-7-(2-methylallyl)-8-(2-methyl-1-piperidyl)purine-2,6-dione CAS Name: 3-methyl-8-(2-methyl-1-piperidinyl)-7-(2-methylprop-2-enyl)purine-2,6-dione IUPAC Name: 3-methyl-8-(2-methylpiperidin-1-yl)-7-(2-methylprop-2-enyl)purine-2,6-dione Traditional Name: 3-methyl-7-(2-methylallyl)-8-(2-methylpiperidino)xanthine Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=NC3=C(N2CC(=C)C)C(=O)NC(=O)N3C

Isomeric SMILES

CC1CCCCN1C2=NC3=C(N2CC(=C)C)C(=O)NC(=O)N3C

InChI

InChI=1S/C16H23N5O2/c1-10(2)9-21-12-13(19(4)16(23)18-14(12)22)17-15(21)20-8-6-5-7-11(20)3/h11H,1,5-9H2,2-4H3,(H,18,22,23)