2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethyl-dimethyl-propyl-azanium

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethyl-dimethyl-propyl-azanium Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)ethyl-dimethyl-propyl-ammonium CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)ethyl-dimethyl-propylammonium IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)ethyl-dimethyl-propylazanium Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)ethyl-dimethyl-propyl-ammonium Formula: C14H24N5O2+ MolecularWeight: 294.37266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)CCN1C(=O)C2=C(N=CN2C)N(C1=O)C

Isomeric SMILES

CCC[N+](C)(C)CCN1C(=O)C2=C(N=CN2C)N(C1=O)C

InChI

InChI=1S/C14H24N5O2/c1-6-8-19(4,5)9-7-18-13(20)11-12(15-10-16(11)2)17(3)14(18)21/h10H,6-9H2,1-5H3/q+1