8-(3,5-dimethylpiperidin-1-ium-1-ylidene)-3-methyl-7-(2-methylprop-2-enyl)-5H-purine-2,6-dione

Systemtic Name: 8-(3,5-dimethylpiperidin-1-ium-1-ylidene)-3-methyl-7-(2-methylprop-2-enyl)-5H-purine-2,6-dione Openeye Name: 8-(3,5-dimethylpiperidin-1-ium-1-ylidene)-3-methyl-7-(2-methylallyl)-5H-purine-2,6-dione CAS Name: 8-(3,5-dimethyl-1-piperidin-1-iumylidene)-3-methyl-7-(2-methylprop-2-enyl)-5H-purine-2,6-dione IUPAC Name: 8-(3,5-dimethylpiperidin-1-ium-1-ylidene)-3-methyl-7-(2-methylprop-2-enyl)-5H-purine-2,6-dione Traditional Name: 8-(3,5-dimethylpiperidin-1-ium-1-ylidene)-3-methyl-7-(2-methylallyl)-5H-purine-2,6-quinone Formula: C17H26N5O2+ MolecularWeight: 332.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[N+](=C2N=C3C(N2CC(=C)C)C(=O)NC(=O)N3C)C1)C

Isomeric SMILES

CC1CC(C[N+](=C2N=C3C(N2CC(=C)C)C(=O)NC(=O)N3C)C1)C

InChI

InChI=1S/C17H25N5O2/c1-10(2)7-22-13-14(20(5)17(24)19-15(13)23)18-16(22)21-8-11(3)6-12(4)9-21/h11-13H,1,6-9H2,2-5H3/p+1