S1V

1-ethanoylpiperidine-4-carbonitrile

Created: 2020-03-03
Last modified:  2020-07-01

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count0
Bond Count23
Aromatic Bond Count0
2D diagram of S1V

Chemical Component Summary

Name1-ethanoylpiperidine-4-carbonitrile
Systematic Name (OpenEye OEToolkits)1-ethanoylpiperidine-4-carbonitrile
FormulaC8 H12 N2 O
Molecular Weight152.194
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CC(=O)N1CCC(CC1)C#N
SMILESOpenEye OEToolkits2.0.6CC(=O)N1CCC(CC1)C#N
Canonical SMILESCACTVS3.385 CC(=O)N1CCC(CC1)C#N
Canonical SMILESOpenEye OEToolkits2.0.6 CC(=O)N1CCC(CC1)C#N
InChIInChI1.03 InChI=1S/C8H12N2O/c1-7(11)10-4-2-8(6-9)3-5-10/h8H,2-5H2,1H3
InChIKeyInChI1.03 NFDGRMQIOHRQHF-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 2756286