4L2

1,4-dimethyl-7-(2-oxopiperidin-1-yl)quinolin-2(1H)-one

Created:2015-04-05
Last modified:  2015-05-20

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Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count0
Bond Count40
Aromatic Bond Count6
2D diagram of 4L2

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Chemical Component Summary

Name1,4-dimethyl-7-(2-oxopiperidin-1-yl)quinolin-2(1H)-one
Systematic Name (OpenEye OEToolkits)1,4-dimethyl-7-(2-oxidanylidenepiperidin-1-yl)quinolin-2-one
FormulaC16 H18 N2 O2
Molecular Weight270.326
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C1CCCCN1c3cc2N(C)C(=O)C=C(C)c2cc3
SMILESCACTVS3.385CN1C(=O)C=C(C)c2ccc(cc12)N3CCCCC3=O
SMILESOpenEye OEToolkits1.9.2CC1=CC(=O)N(c2c1ccc(c2)N3CCCCC3=O)C
Canonical SMILESCACTVS3.385 CN1C(=O)C=C(C)c2ccc(cc12)N3CCCCC3=O
Canonical SMILESOpenEye OEToolkits1.9.2 CC1=CC(=O)N(c2c1ccc(c2)N3CCCCC3=O)C
InChIInChI1.03 InChI=1S/C16H18N2O2/c1-11-9-16(20)17(2)14-10-12(6-7-13(11)14)18-8-4-3-5-15(18)19/h6-7,9-10H,3-5,8H2,1-2H3
InChIKeyInChI1.03 TVJZEYRKRPKMHK-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 91757967