U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C22H17NO3
Molecular Weight 343.3753
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(1,3-BENZODIOXOL-5-YL)-N,N-DIPHENYLPROP-2-ENAMIDE, (2E)-

SMILES

O=C(\C=C\C1=CC=C2OCOC2=C1)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=KVLXSHZWAOZSIU-WYMLVPIESA-N
InChI=1S/C22H17NO3/c24-22(14-12-17-11-13-20-21(15-17)26-16-25-20)23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,16H2/b14-12+

HIDE SMILES / InChI

Molecular Formula C22H17NO3
Molecular Weight 343.3753
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 14:31:28 GMT 2023
Edited
by admin
on Sat Dec 16 14:31:28 GMT 2023
Record UNII
0TA0227SQW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(1,3-BENZODIOXOL-5-YL)-N,N-DIPHENYLPROP-2-ENAMIDE, (2E)-
Systematic Name English
3-BENZO(1,3)DIOXOL-5-YL-N,N-DIPHENYL-2-PROPENAMIDE, (E)-
Systematic Name English
FEMA NO. 4788
Code English
Code System Code Type Description
PUBCHEM
68085257
Created by admin on Sat Dec 16 14:31:28 GMT 2023 , Edited by admin on Sat Dec 16 14:31:28 GMT 2023
PRIMARY
FDA UNII
0TA0227SQW
Created by admin on Sat Dec 16 14:31:28 GMT 2023 , Edited by admin on Sat Dec 16 14:31:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID601019527
Created by admin on Sat Dec 16 14:31:28 GMT 2023 , Edited by admin on Sat Dec 16 14:31:28 GMT 2023
PRIMARY
CAS
1309389-73-8
Created by admin on Sat Dec 16 14:31:28 GMT 2023 , Edited by admin on Sat Dec 16 14:31:28 GMT 2023
PRIMARY