C2T

3-(1-Ethyl-1,1-dimethylhydrazin-1-ium-2-yl)propanoic acid

Created:2013-04-02
Last modified:  2014-09-05

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Chemical Details

Formal Charge1
Atom Count28
Chiral Atom Count0
Bond Count27
Aromatic Bond Count0
2D diagram of C2T

Chemical Component Summary

Name3-(1-Ethyl-1,1-dimethylhydrazin-1-ium-2-yl)propanoic acid
Systematic Name (OpenEye OEToolkits)ethyl-(3-hydroxy-3-oxopropylamino)-dimethyl-azanium
FormulaC7 H17 N2 O2
Molecular Weight161.222
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)CCN[N+](C)(C)CC
SMILESCACTVS3.385CC[N+](C)(C)NCCC(O)=O
SMILESOpenEye OEToolkits1.9.2CC[N+](C)(C)NCCC(=O)O
Canonical SMILESCACTVS3.385 CC[N+](C)(C)NCCC(O)=O
Canonical SMILESOpenEye OEToolkits1.9.2 CC[N+](C)(C)NCCC(=O)O
InChIInChI1.03 InChI=1S/C7H16N2O2/c1-4-9(2,3)8-6-5-7(10)11/h8H,4-6H2,1-3H3/p+1
InChIKeyInChI1.03 VFMQJOHSAQMQEH-UHFFFAOYSA-O

Related Resource References

Resource NameReference
PubChem 13794690