[2-[2-(2,2-dimethylpropanoylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]-2-oxidanylidene-ethyl] 2-chloranylethanoate

Systemtic Name: [2-[2-(2,2-dimethylpropanoylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]-2-oxidanylidene-ethyl] 2-chloranylethanoate Openeye Name: [2-[2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]-2-oxo-ethyl] 2-chloroacetate CAS Name: 2-chloroacetic acid [2-[2-[(2,2-dimethyl-1-oxopropyl)amino]-4-oxo-1H-pyrimidin-6-yl]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]-2-oxoethyl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [2-keto-2-[4-keto-2-(pivaloylamino)-1H-pyrimidin-6-yl]ethyl] ester Formula: C13H16ClN3O5 MolecularWeight: 329.73624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=NC(=O)C=C(N1)C(=O)COC(=O)CCl

Isomeric SMILES

CC(C)(C)C(=O)NC1=NC(=O)C=C(N1)C(=O)COC(=O)CCl

InChI

InChI=1S/C13H16ClN3O5/c1-13(2,3)11(21)17-12-15-7(4-9(19)16-12)8(18)6-22-10(20)5-14/h4H,5-6H2,1-3H3,(H2,15,16,17,19,21)