diethyl (2R)-2-(6-oxidanylidene-3H-purin-9-yl)butanedioate

Systemtic Name: diethyl (2R)-2-(6-oxidanylidene-3H-purin-9-yl)butanedioate Openeye Name: diethyl (2R)-2-(6-oxo-3H-purin-9-yl)butanedioate CAS Name: (2R)-2-(6-oxo-3H-purin-9-yl)butanedioic acid diethyl ester IUPAC Name: diethyl (2R)-2-(6-oxo-3H-purin-9-yl)butanedioate Traditional Name: (2R)-2-(6-keto-3H-purin-9-yl)succinic acid diethyl ester Formula: C13H16N4O5 MolecularWeight: 308.28994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)OCC)N1C=NC2=C1NC=NC2=O

Isomeric SMILES

CCOC(=O)C[C@H](C(=O)OCC)N1C=NC2=C1NC=NC2=O

InChI

InChI=1S/C13H16N4O5/c1-3-21-9(18)5-8(13(20)22-4-2)17-7-16-10-11(17)14-6-15-12(10)19/h6-8H,3-5H2,1-2H3,(H,14,15,19)/t8-/m1/s1