dimethyl-[2-[[3-methyl-2,6-bis(oxidanylidene)-7-prop-2-enyl-purin-8-yl]amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[3-methyl-2,6-bis(oxidanylidene)-7-prop-2-enyl-purin-8-yl]amino]ethyl]azanium Openeye Name: 2-[(7-allyl-3-methyl-2,6-dioxo-purin-8-yl)amino]ethyl-dimethyl-ammonium CAS Name: dimethyl-[2-[(3-methyl-2,6-dioxo-7-prop-2-enyl-8-purinyl)amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[(3-methyl-2,6-dioxo-7-prop-2-enylpurin-8-yl)amino]ethyl]azanium Traditional Name: 2-[(7-allyl-2,6-diketo-3-methyl-purin-8-yl)amino]ethyl-dimethyl-ammonium Formula: C13H21N6O2+ MolecularWeight: 293.34484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCC[NH+](C)C)CC=C

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCC[NH+](C)C)CC=C

InChI

InChI=1S/C13H20N6O2/c1-5-7-19-9-10(18(4)13(21)16-11(9)20)15-12(19)14-6-8-17(2)3/h5H,1,6-8H2,2-4H3,(H,14,15)(H,16,20,21)/p+1