8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C14H23N6O2+ MolecularWeight: 307.37142

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C14H22N6O2/c1-4-19-5-7-20(8-6-19)9-10-15-11-12(16-10)17(2)14(22)18(3)13(11)21/h4-9H2,1-3H3,(H,15,16)/p+1