p-Chlorofentanyl (CHEBI:231308)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	p-Chlorofentanyl

ChEBI ID	CHEBI:231308

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C22H27ClN2O

Net Charge

Average Mass

370.920

Monoisotopic Mass

370.18119

InChI

InChI=1S/C22H27ClN2O/c1-2-22(26)25(20-10-8-19(23)9-11-20)21-13-16-24(17-14-21)15-12-18-6-4-3-5-7-18/h3-11,21H,2,12-17H2,1H3

InChIKey

CUGMWAHBYRKBKL-UHFFFAOYSA-N

SMILES

ClC1=CC=C(N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)CC)C=C1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	p-Chlorofentanyl (CHEBI:231308) is a piperidines (CHEBI:26151)

IUPAC Name

N-(4-chlorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide