ethyl 2-[1-(2-bromanylethanoyl)-5,5-dimethyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-(2-bromanylethanoyl)-5,5-dimethyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-(2-bromoacetyl)-5,5-dimethyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(2-bromo-1-oxoethyl)-5,5-dimethyl-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(2-bromoacetyl)-5,5-dimethyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(2-bromoacetyl)-3-keto-5,5-dimethyl-piperazin-2-yl]acetic acid ethyl ester Formula: C12H19BrN2O4 MolecularWeight: 335.19426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NC(CN1C(=O)CBr)(C)C

Isomeric SMILES

CCOC(=O)CC1C(=O)NC(CN1C(=O)CBr)(C)C

InChI

InChI=1S/C12H19BrN2O4/c1-4-19-10(17)5-8-11(18)14-12(2,3)7-15(8)9(16)6-13/h8H,4-7H2,1-3H3,(H,14,18)