1-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]piperidine-4-carboxamide

Systemtic Name: 1-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]piperidine-4-carboxamide Openeye Name: 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)piperidine-4-carboxamide CAS Name: 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-piperidinecarboxamide IUPAC Name: 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)piperidine-4-carboxamide Traditional Name: 1-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)isonipecotamide Formula: C13H18N6O3 MolecularWeight: 306.32042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCC(CC3)C(=O)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C13H18N6O3/c1-17-10-8(11(21)18(2)13(17)22)15-12(16-10)19-5-3-7(4-6-19)9(14)20/h7H,3-6H2,1-2H3,(H2,14,20)(H,15,16)