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Details

Stereochemistry RACEMIC
Molecular Formula C14H17NO3
Molecular Weight 247.2897
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 1-BENZYL-4-OXO-3-PIPERIDINECARBOXYLATE

SMILES

COC(=O)C1CN(CC2=CC=CC=C2)CCC1=O

InChI

InChIKey=PHTILULPLFUXPS-UHFFFAOYSA-N
InChI=1S/C14H17NO3/c1-18-14(17)12-10-15(8-7-13(12)16)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
METHYL 1-BENZYL-4-OXO-3-PIPERIDINECARBOXYLATE
Systematic Name English
METHYL 1-BENZYL-1,2,5,6-TETRAHYDRO-4-HYDROXYNICOTINATE
Preferred Name English
3-PIPERIDINECARBOXYLIC ACID, 4-OXO-1-(PHENYLMETHYL)-, METHYL ESTER
Systematic Name English
3-PYRIDINECARBOXYLIC ACID, 1,2,5,6-TETRAHYDRO-4-HYDROXY-1-(PHENYLMETHYL)-, METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
97692-42-7
Created by admin on Tue Apr 01 19:05:48 GMT 2025 , Edited by admin on Tue Apr 01 19:05:48 GMT 2025
ALTERNATIVE
ECHA (EC/EINECS)
307-695-2
Created by admin on Tue Apr 01 19:05:48 GMT 2025 , Edited by admin on Tue Apr 01 19:05:48 GMT 2025
PRIMARY
FDA UNII
A3J5GO5I1T
Created by admin on Tue Apr 01 19:05:48 GMT 2025 , Edited by admin on Tue Apr 01 19:05:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID10276037
Created by admin on Tue Apr 01 19:05:48 GMT 2025 , Edited by admin on Tue Apr 01 19:05:48 GMT 2025
PRIMARY
CAS
57611-47-9
Created by admin on Tue Apr 01 19:05:48 GMT 2025 , Edited by admin on Tue Apr 01 19:05:48 GMT 2025
PRIMARY
PUBCHEM
107480
Created by admin on Tue Apr 01 19:05:48 GMT 2025 , Edited by admin on Tue Apr 01 19:05:48 GMT 2025
PRIMARY
NIH
NCATS
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