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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13NO4
Molecular Weight 235.2359
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2-((Allylamino)carbonyl)phenoxy)acetic acid

SMILES

OC(=O)COC1=C(C=CC=C1)C(=O)NCC=C

InChI

InChIKey=IHBWXJXQXPFUAE-UHFFFAOYSA-N
InChI=1S/C12H13NO4/c1-2-7-13-12(16)9-5-3-4-6-10(9)17-8-11(14)15/h2-6H,1,7-8H2,(H,13,16)(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H13NO4
Molecular Weight 235.2359
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 12:39:22 GMT 2023
Edited
by admin
on Sat Dec 16 12:39:22 GMT 2023
Record UNII
SKQ435QCP5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2-((Allylamino)carbonyl)phenoxy)acetic acid
Systematic Name English
Acetic acid, 2-[2-[(2-propen-1-ylamino)carbonyl]phenoxy]-
Systematic Name English
2-[2-[(2-Propen-1-ylamino)carbonyl]phenoxy]acetic acid
Systematic Name English
NSC-59836
Code English
Code System Code Type Description
NSC
59836
Created by admin on Sat Dec 16 12:39:22 GMT 2023 , Edited by admin on Sat Dec 16 12:39:22 GMT 2023
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FDA UNII
SKQ435QCP5
Created by admin on Sat Dec 16 12:39:22 GMT 2023 , Edited by admin on Sat Dec 16 12:39:22 GMT 2023
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PUBCHEM
67066
Created by admin on Sat Dec 16 12:39:22 GMT 2023 , Edited by admin on Sat Dec 16 12:39:22 GMT 2023
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CAS
119-45-9
Created by admin on Sat Dec 16 12:39:22 GMT 2023 , Edited by admin on Sat Dec 16 12:39:22 GMT 2023
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EPA CompTox
DTXSID30152283
Created by admin on Sat Dec 16 12:39:22 GMT 2023 , Edited by admin on Sat Dec 16 12:39:22 GMT 2023
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ECHA (EC/EINECS)
204-326-6
Created by admin on Sat Dec 16 12:39:22 GMT 2023 , Edited by admin on Sat Dec 16 12:39:22 GMT 2023
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