SNU

4-(1H-pyrrol-1-yl)aniline

Created:2011-07-11
Last modified:  2013-01-25

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Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count0
Bond Count23
Aromatic Bond Count11
2D diagram of SNU

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Chemical Component Summary

Name4-(1H-pyrrol-1-yl)aniline
Systematic Name (OpenEye OEToolkits)4-pyrrol-1-ylaniline
FormulaC10 H10 N2
Molecular Weight158.2
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1(ccc(cc1)n2cccc2)N
SMILESCACTVS3.370Nc1ccc(cc1)n2cccc2
SMILESOpenEye OEToolkits1.7.2c1ccn(c1)c2ccc(cc2)N
Canonical SMILESCACTVS3.370 Nc1ccc(cc1)n2cccc2
Canonical SMILESOpenEye OEToolkits1.7.2 c1ccn(c1)c2ccc(cc2)N
InChIInChI1.03 InChI=1S/C10H10N2/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h1-8H,11H2
InChIKeyInChI1.03 NHLHWHRXMZZWGA-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 2795457