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Details

Stereochemistry RACEMIC
Molecular Formula C12H11NO5
Molecular Weight 249.2194
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(Benzyloxycarbonyl)aspartic anhydride

SMILES

O=C(NC1CC(=O)OC1=O)OCC2=CC=CC=C2

InChI

InChIKey=OZPYEGOBGWQOSZ-UHFFFAOYSA-N
InChI=1S/C12H11NO5/c14-10-6-9(11(15)18-10)13-12(16)17-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,16)

HIDE SMILES / InChI

Molecular Formula C12H11NO5
Molecular Weight 249.2194
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:36:28 GMT 2025
Edited
by admin
on Mon Mar 31 23:36:28 GMT 2025
Record UNII
P2RY6XP2JT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-117449
Preferred Name English
N-(Benzyloxycarbonyl)aspartic anhydride
Systematic Name English
Aspartic anhydride, N-carboxy-, benzyl ester
Systematic Name English
Carbamic acid, (tetrahydro-2,5-dioxo-3-furanyl)-, phenylmethyl ester
Systematic Name English
Carbamic acid, N-(tetrahydro-2,5-dioxo-3-furanyl)-, phenylmethyl ester
Systematic Name English
Code System Code Type Description
NSC
117449
Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025
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EPA CompTox
DTXSID70276033
Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025
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CAS
35739-00-5
Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025
PRIMARY
PUBCHEM
107296
Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025
PRIMARY
FDA UNII
P2RY6XP2JT
Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025
PRIMARY