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Details

Stereochemistry ACHIRAL
Molecular Formula C18H26N2O3
Molecular Weight 318.4106
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(dimethylamino)-2-[3-(dimethylamino)propanoyl]-1-(4-hydroxyphenyl)pent-1-en-3-one

SMILES

CN(C)CCC(=O)C(=CC1=CC=C(O)C=C1)C(=O)CCN(C)C

InChI

InChIKey=MZIXAUGYHJEFFF-UHFFFAOYSA-N
InChI=1S/C18H26N2O3/c1-19(2)11-9-17(22)16(18(23)10-12-20(3)4)13-14-5-7-15(21)8-6-14/h5-8,13,21H,9-12H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C18H26N2O3
Molecular Weight 318.4106
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 Tue Apr 01 19:46:28 GMT 2025
Edited
by admin
on Tue Apr 01 19:46:28 GMT 2025
Record UNII
X22KCQ7947
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,7-BIS(DIMETHYLAMINO)-4-(4-HYDROXYBENZYLIDENE)-3,5-HEPTANEDIONE
Preferred Name English
5-(dimethylamino)-2-[3-(dimethylamino)propanoyl]-1-(4-hydroxyphenyl)pent-1-en-3-one
Systematic Name English
3,5-Heptanedione, 1,7-bis(dimethylamino)-4-[(4-hydroxyphenyl)methylene]-
Systematic Name English
Code System Code Type Description
FDA UNII
X22KCQ7947
Created by admin on Tue Apr 01 19:46:28 GMT 2025 , Edited by admin on Tue Apr 01 19:46:28 GMT 2025
PRIMARY
CAS
87497-42-5
Created by admin on Tue Apr 01 19:46:28 GMT 2025 , Edited by admin on Tue Apr 01 19:46:28 GMT 2025
PRIMARY
PUBCHEM
433998
Created by admin on Tue Apr 01 19:46:28 GMT 2025 , Edited by admin on Tue Apr 01 19:46:28 GMT 2025
PRIMARY