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

Systemtic Name: ethyl 2-[1-(3-bromanylpropanoyl)-5,5-dimethyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-(3-bromopropanoyl)-5,5-dimethyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(3-bromo-1-oxopropyl)-5,5-dimethyl-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(3-bromopropanoyl)-5,5-dimethyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3-bromopropanoyl)-3-keto-5,5-dimethyl-piperazin-2-yl]acetic acid ethyl ester Formula: C13H21BrN2O4 MolecularWeight: 349.22084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21BrN2O4/c1-4-20-11(18)7-9-12(19)15-13(2,3)8-16(9)10(17)5-6-14/h9H,4-8H2,1-3H3,(H,15,19)