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Details

Stereochemistry RACEMIC
Molecular Formula C19H25NO
Molecular Weight 283.4079
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-ONE, (3E)-

SMILES

CN(C)C1=CC=C(C=C1)\C=C2/[C@H]3CC[C@@](C)(C2=O)C3(C)C

InChI

InChIKey=UEYUPBGEMWUNTA-XUNQVJEASA-N
InChI=1S/C19H25NO/c1-18(2)16-10-11-19(18,3)17(21)15(16)12-13-6-8-14(9-7-13)20(4)5/h6-9,12,16H,10-11H2,1-5H3/b15-12+/t16-,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H25NO
Molecular Weight 283.4079
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:12:22 GMT 2023
Edited
by admin
on Sat Dec 16 10:12:22 GMT 2023
Record UNII
5RYT7QW9G5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-ONE, (3E)-
Systematic Name English
BICYCLO(2.2.1)HEPTAN-2-ONE, 3-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-1,7,7-TRIMETHYL-, (3E)-
Systematic Name English
3-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-ONE
Systematic Name English
BICYCLO(2.2.1)HEPTAN-2-ONE, 3-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-1,7,7-TRIMETHYL-
Systematic Name English
N,N-DIMETHYL-4-((E)-(-4,7,7-TRIMETHYL-3-OXOBICYCLO(2,2,1)HEPT-2-YLIDENE)METHYL)AMINOBENZENE
Common Name English
1,7,7-TRIMETHYL-3-(4-DIMETHYLAMINO)BENZYLIDENE(2,2,1)-BICYCLO-2-HEPTANONE
Systematic Name English
(3E)-3-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
156613675
Created by admin on Sat Dec 16 10:12:22 GMT 2023 , Edited by admin on Sat Dec 16 10:12:22 GMT 2023
PRIMARY
FDA UNII
5RYT7QW9G5
Created by admin on Sat Dec 16 10:12:22 GMT 2023 , Edited by admin on Sat Dec 16 10:12:22 GMT 2023
PRIMARY
CAS
52793-84-7
Created by admin on Sat Dec 16 10:12:22 GMT 2023 , Edited by admin on Sat Dec 16 10:12:22 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CAS
119678-44-3
Created by admin on Sat Dec 16 10:12:22 GMT 2023 , Edited by admin on Sat Dec 16 10:12:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID601134159
Created by admin on Sat Dec 16 10:12:22 GMT 2023 , Edited by admin on Sat Dec 16 10:12:22 GMT 2023
PRIMARY