2-[3-(4-chloranylpyrazol-1-yl)propanoylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[3-(4-chloranylpyrazol-1-yl)propanoylamino]ethyl-diethyl-azanium Openeye Name: 2-[3-(4-chloropyrazol-1-yl)propanoylamino]ethyl-diethyl-ammonium CAS Name: 2-[[3-(4-chloro-1-pyrazolyl)-1-oxopropyl]amino]ethyl-diethylammonium IUPAC Name: 2-[3-(4-chloropyrazol-1-yl)propanoylamino]ethyl-diethylazanium Traditional Name: 2-[3-(4-chloropyrazol-1-yl)propanoylamino]ethyl-diethyl-ammonium Formula: C12H22ClN4O+ MolecularWeight: 273.78228

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)CCN1C=C(C=N1)Cl

Isomeric SMILES

CC[NH+](CC)CCNC(=O)CCN1C=C(C=N1)Cl

InChI

InChI=1S/C12H21ClN4O/c1-3-16(4-2)8-6-14-12(18)5-7-17-10-11(13)9-15-17/h9-10H,3-8H2,1-2H3,(H,14,18)/p+1