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

Systemtic Name: 1-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C14H21N6O3+ MolecularWeight: 321.35494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C14H20N6O3/c1-18-12-10(13(22)19(2)14(18)23)16-9(17-12)7-20-5-3-8(4-6-20)11(15)21/h8H,3-7H2,1-2H3,(H2,15,21)(H,16,17)/p+1