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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H15NO2.ClH
Molecular Weight 241.714
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzyl prolinate hydrochloride

SMILES

Cl.O=C(OCC1=CC=CC=C1)[C@@H]2CCCN2

InChI

InChIKey=NEDMOHHWRPHBAL-MERQFXBCSA-N
InChI=1S/C12H15NO2.ClH/c14-12(11-7-4-8-13-11)15-9-10-5-2-1-3-6-10;/h1-3,5-6,11,13H,4,7-9H2;1H/t11-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C12H15NO2
Molecular Weight 205.253
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:51:02 GMT 2023
Edited
by admin
on Sat Dec 16 19:51:02 GMT 2023
Record UNII
ZK3TE62WVS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzyl prolinate hydrochloride
Common Name English
L-Proline benzyl ester hydrochloride
Common Name English
L-Proline, phenylmethyl ester, hydrochloride (1:1)
Systematic Name English
NSC-71043
Code English
NSC -197199
Code English
Code System Code Type Description
NSC
197199
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
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NSC
71043
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY
CAS
16652-71-4
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY
FDA UNII
ZK3TE62WVS
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY
PUBCHEM
2733413
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY