3-methylbutyl 2-[1-(2-bromanylethanoyl)-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[1-(2-bromanylethanoyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[1-(2-bromoacetyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(2-bromo-1-oxoethyl)-3-oxo-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[1-(2-bromoacetyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(2-bromoacetyl)-3-keto-piperazin-2-yl]acetic acid isoamyl ester Formula: C13H21BrN2O4 MolecularWeight: 349.22084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)CBr

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)CBr

InChI

InChI=1S/C13H21BrN2O4/c1-9(2)3-6-20-12(18)7-10-13(19)15-4-5-16(10)11(17)8-14/h9-10H,3-8H2,1-2H3,(H,15,19)