(4-(m-chlorophenylcarbamoyloxy)-2-butynyl)trimethylammonium (Q27281599)

UNII-JO67EL43YO (English)

14 October 2016

chemical formula

C₁₄H₁₈ClN₂O₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C[N+](C)(C)CC#CCOC(=O)NC1=CC(=CC=C1)Cl

1 reference

UNII-JO67EL43YO (English)

InChI=1S/C14H17ClN2O2/c1-17(2,3)9-4-5-10-19-14(18)16-13-8-6-7-12(15)11-13/h6-8,11H,9-10H2,1-3H3/p+1

14 October 2016

Identifiers

InChI

1 reference

UNII-JO67EL43YO (English)

DDKOMKXCUXCQBS-UHFFFAOYSA-O

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-JO67EL43YO (English)

14 October 2016

1 reference

UNII

JO67EL43YO

(4-(m-chlorophenylcarbamoyloxy)-2-butynyl)trimethylammonium (English)

14 October 2016

1 reference

4-{[(3-Chlorophenyl)carbamoyl]oxy}-N,N,N-trimethyl-2-butyn-1-aminium (English)

14 October 2016

1 reference

UNII-JO67EL43YO (English)

14 October 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

CHEMBL40554 (English)

14 October 2016

1 reference

1 reference

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

UNII

JO67EL43YO

(4-(m-chlorophenylcarbamoyloxy)-2-butynyl)trimethylammonium (English)