8-[2-(diethylazaniumyl)ethylamino]-3-methyl-6-oxidanylidene-7-[(2S)-2-oxidanylpropyl]purin-2-olate

Systemtic Name: 8-[2-(diethylazaniumyl)ethylamino]-3-methyl-6-oxidanylidene-7-[(2S)-2-oxidanylpropyl]purin-2-olate Openeye Name: 8-[2-(diethylammonio)ethylamino]-7-[(2S)-2-hydroxypropyl]-3-methyl-6-oxo-purin-2-olate CAS Name: 8-[2-(diethylammonio)ethylamino]-7-[(2S)-2-hydroxypropyl]-3-methyl-6-oxo-2-purinolate IUPAC Name: 8-[2-(diethylazaniumyl)ethylamino]-7-[(2S)-2-hydroxypropyl]-3-methyl-6-oxopurin-2-olate Traditional Name: 8-[2-(diethylammonio)ethylamino]-7-[(2S)-2-hydroxypropyl]-6-keto-3-methyl-purin-2-olate Formula: C15H26N6O3 MolecularWeight: 338.40534

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC2=C(N1CC(C)O)C(=O)N=C(N2C)[O-]

Isomeric SMILES

CC[NH+](CC)CCNC1=NC2=C(N1C[C@H](C)O)C(=O)N=C(N2C)[O-]

InChI

InChI=1S/C15H26N6O3/c1-5-20(6-2)8-7-16-14-17-12-11(21(14)9-10(3)22)13(23)18-15(24)19(12)4/h10,22H,5-9H2,1-4H3,(H,16,17)(H,18,23,24)/t10-/m0/s1