[3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-2-oxidanyl-propyl] (1Z)-N-oxidanylethanimidate

Systemtic Name: [3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-2-oxidanyl-propyl] (1Z)-N-oxidanylethanimidate Openeye Name: [3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-2-hydroxy-propyl] (1Z)-N-hydroxyethanimidate CAS Name: (1Z)-N-hydroxyethanimidic acid [3-(3,7-dimethyl-2,6-dioxo-1-purinyl)-2-hydroxypropyl] ester IUPAC Name: [3-(3,7-dimethyl-2,6-dioxopurin-1-yl)-2-hydroxypropyl] (1Z)-N-hydroxyethanimidate Traditional Name: (1Z)-N-hydroxyacetimidic acid [3-(2,6-diketo-3,7-dimethyl-purin-1-yl)-2-hydroxy-propyl] ester Formula: C12H17N5O5 MolecularWeight: 311.29388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)OCC(CN1C(=O)C2=C(N=CN2C)N(C1=O)C)O

Isomeric SMILES

C/C(=N/O)/OCC(CN1C(=O)C2=C(N=CN2C)N(C1=O)C)O

InChI

InChI=1S/C12H17N5O5/c1-7(14-21)22-5-8(18)4-17-11(19)9-10(13-6-15(9)2)16(3)12(17)20/h6,8,18,21H,4-5H2,1-3H3/b14-7-