3-[[(2S)-2-(4-bromanylpyrazol-1-yl)propanoyl]amino]propyl-diethyl-azanium

Systemtic Name: 3-[[(2S)-2-(4-bromanylpyrazol-1-yl)propanoyl]amino]propyl-diethyl-azanium Openeye Name: 3-[[(2S)-2-(4-bromopyrazol-1-yl)propanoyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[(2S)-2-(4-bromo-1-pyrazolyl)-1-oxopropyl]amino]propyl-diethylammonium IUPAC Name: 3-[[(2S)-2-(4-bromopyrazol-1-yl)propanoyl]amino]propyl-diethylazanium Traditional Name: 3-[[(2S)-2-(4-bromopyrazol-1-yl)propanoyl]amino]propyl-diethyl-ammonium Formula: C13H24BrN4O+ MolecularWeight: 332.25986

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C(C)N1C=C(C=N1)Br

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)[C@H](C)N1C=C(C=N1)Br

InChI

InChI=1S/C13H23BrN4O/c1-4-17(5-2)8-6-7-15-13(19)11(3)18-10-12(14)9-16-18/h9-11H,4-8H2,1-3H3,(H,15,19)/p+1/t11-/m0/s1