methyl 2-[2-(4-bromanylpyrazol-1-yl)butanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(4-bromanylpyrazol-1-yl)butanoylamino]ethanoate Openeye Name: methyl 2-[2-(4-bromopyrazol-1-yl)butanoylamino]acetate CAS Name: 2-[[2-(4-bromo-1-pyrazolyl)-1-oxobutyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[2-(4-bromopyrazol-1-yl)butanoylamino]acetate Traditional Name: 2-[2-(4-bromopyrazol-1-yl)butanoylamino]acetic acid methyl ester Formula: C10H14BrN3O3 MolecularWeight: 304.14046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC(=O)OC)N1C=C(C=N1)Br

Isomeric SMILES

CCC(C(=O)NCC(=O)OC)N1C=C(C=N1)Br

InChI

InChI=1S/C10H14BrN3O3/c1-3-8(14-6-7(11)4-13-14)10(16)12-5-9(15)17-2/h4,6,8H,3,5H2,1-2H3,(H,12,16)