MVN

6-chloro-4-methyl-1H-quinolin-2-one

Created: 2014-02-26
Last modified:  2015-02-11

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count0
Bond Count22
Aromatic Bond Count6
2D diagram of MVN

Chemical Component Summary

Name6-chloro-4-methyl-1H-quinolin-2-one
Systematic Name (OpenEye OEToolkits)6-chloranyl-4-methyl-1H-quinolin-2-one
FormulaC10 H8 Cl N O
Molecular Weight193.63
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01Clc2ccc1c(C(=CC(=O)N1)C)c2
SMILESCACTVS3.385CC1=CC(=O)Nc2ccc(Cl)cc12
SMILESOpenEye OEToolkits1.7.6CC1=CC(=O)Nc2c1cc(cc2)Cl
Canonical SMILESCACTVS3.385 CC1=CC(=O)Nc2ccc(Cl)cc12
Canonical SMILESOpenEye OEToolkits1.7.6 CC1=CC(=O)Nc2c1cc(cc2)Cl
InChIInChI1.03 InChI=1S/C10H8ClNO/c1-6-4-10(13)12-9-3-2-7(11)5-8(6)9/h2-5H,1H3,(H,12,13)
InChIKeyInChI1.03 VQMIYHVFVPSLGB-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 606322
ChEMBL CHEMBL1581299