[5-[(E)-2-bromanylethenyl]-1-(2-hydroxyethyloxymethyl)-2-oxidanylidene-pyrimidin-4-yl] ethanoate

Systemtic Name: [5-[(E)-2-bromanylethenyl]-1-(2-hydroxyethyloxymethyl)-2-oxidanylidene-pyrimidin-4-yl] ethanoate Openeye Name: [5-[(E)-2-bromovinyl]-1-(2-hydroxyethoxymethyl)-2-oxo-pyrimidin-4-yl] acetate CAS Name: acetic acid [5-[(E)-2-bromoethenyl]-1-(2-hydroxyethoxymethyl)-2-oxo-4-pyrimidinyl] ester IUPAC Name: [5-[(E)-2-bromoethenyl]-1-(2-hydroxyethoxymethyl)-2-oxopyrimidin-4-yl] acetate Traditional Name: acetic acid [5-[(E)-2-bromovinyl]-1-(2-hydroxyethoxymethyl)-2-keto-pyrimidin-4-yl] ester Formula: C11H13BrN2O5 MolecularWeight: 333.13532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=NC(=O)N(C=C1C=CBr)COCCO

Isomeric SMILES

CC(=O)OC1=NC(=O)N(C=C1/C=C/Br)COCCO

InChI

InChI=1S/C11H13BrN2O5/c1-8(16)19-10-9(2-3-12)6-14(11(17)13-10)7-18-5-4-15/h2-3,6,15H,4-5,7H2,1H3/b3-2+