ethyl 4-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]butanoate CAS Name: 4-[[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]amino]butyric acid ethyl ester Formula: C15H21N5O5 MolecularWeight: 351.35774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C15H21N5O5/c1-4-25-11(22)6-5-7-16-10(21)8-20-9-17-13-12(20)14(23)19(3)15(24)18(13)2/h9H,4-8H2,1-3H3,(H,16,21)