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Details

Stereochemistry ACHIRAL
Molecular Formula C19H20O2
Molecular Weight 280.3609
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (4E)-7-(1,1′-BIPHENYL)-4-YL-4-HEPTENOIC ACID

SMILES

OC(=O)CC\C=C\CCC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChIKey=AGPBAQMIWGSUFX-OWOJBTEDSA-N
InChI=1S/C19H20O2/c20-19(21)11-7-2-1-4-8-16-12-14-18(15-13-16)17-9-5-3-6-10-17/h1-3,5-6,9-10,12-15H,4,7-8,11H2,(H,20,21)/b2-1+

HIDE SMILES / InChI

Molecular Formula C19H20O2
Molecular Weight 280.3609
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:27:15 GMT 2023
Edited
by admin
on Sat Dec 16 18:27:15 GMT 2023
Record UNII
M72MM22KTK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4E)-7-(1,1′-BIPHENYL)-4-YL-4-HEPTENOIC ACID
Systematic Name English
4-HEPTENOIC ACID, 7-(1,1′-BIPHENYL)-4-YL-, (4E)-
Systematic Name English
IBI-165
Code English
IBI165
Code English
Code System Code Type Description
FDA UNII
M72MM22KTK
Created by admin on Sat Dec 16 18:27:15 GMT 2023 , Edited by admin on Sat Dec 16 18:27:15 GMT 2023
PRIMARY
CAS
477327-29-0
Created by admin on Sat Dec 16 18:27:15 GMT 2023 , Edited by admin on Sat Dec 16 18:27:15 GMT 2023
PRIMARY
PUBCHEM
12097364
Created by admin on Sat Dec 16 18:27:15 GMT 2023 , Edited by admin on Sat Dec 16 18:27:15 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY