VJP

1-[(4-aminophenyl)sulfonyl]piperidin-2-one

Created: 2014-07-02
Last modified:  2015-03-04

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Chemical Details

Formal Charge0
Atom Count31
Chiral Atom Count0
Bond Count32
Aromatic Bond Count6
2D diagram of VJP

Chemical Component Summary

Name1-[(4-aminophenyl)sulfonyl]piperidin-2-one
Systematic Name (OpenEye OEToolkits)1-(4-aminophenyl)sulfonylpiperidin-2-one
FormulaC11 H14 N2 O3 S
Molecular Weight254.305
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C2N(S(=O)(=O)c1ccc(N)cc1)CCCC2
SMILESCACTVS3.385Nc1ccc(cc1)[S](=O)(=O)N2CCCCC2=O
SMILESOpenEye OEToolkits1.7.6c1cc(ccc1N)S(=O)(=O)N2CCCCC2=O
Canonical SMILESCACTVS3.385 Nc1ccc(cc1)[S](=O)(=O)N2CCCCC2=O
Canonical SMILESOpenEye OEToolkits1.7.6 c1cc(ccc1N)S(=O)(=O)N2CCCCC2=O
InChIInChI1.03 InChI=1S/C11H14N2O3S/c12-9-4-6-10(7-5-9)17(15,16)13-8-2-1-3-11(13)14/h4-7H,1-3,8,12H2
InChIKeyInChI1.03 OWUDZSOVUCVZKR-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 90657104
ChEMBL CHEMBL3414694