ZT7

1-(5-amino-2H-isoindol-2-yl)ethan-1-one

Created: 2023-07-03
Last modified:  2023-07-12

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count0
Bond Count24
Aromatic Bond Count10
2D diagram of ZT7

Chemical Component Summary

Name1-(5-amino-2H-isoindol-2-yl)ethan-1-one
Systematic Name (OpenEye OEToolkits)1-(5-azanylisoindol-2-yl)ethanone
FormulaC10 H10 N2 O
Molecular Weight174.199
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01CC(=O)n1cc2ccc(N)cc2c1
SMILESCACTVS3.385CC(=O)n1cc2ccc(N)cc2c1
SMILESOpenEye OEToolkits2.0.7CC(=O)n1cc2ccc(cc2c1)N
Canonical SMILESCACTVS3.385 CC(=O)n1cc2ccc(N)cc2c1
Canonical SMILESOpenEye OEToolkits2.0.7 CC(=O)n1cc2ccc(cc2c1)N
InChIInChI1.06 InChI=1S/C10H10N2O/c1-7(13)12-5-8-2-3-10(11)4-9(8)6-12/h2-6H,11H2,1H3
InChIKeyInChI1.06 QUEOWOVPZRUSRH-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 168376961