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Details

Stereochemistry ACHIRAL
Molecular Formula C14H17NO2
Molecular Weight 231.2903
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(3-METHOXYPHENYL)-1-PYRROLIDIN-1-YL-PROP-2-EN-1-ONE

SMILES

COC1=CC=CC(\C=C\C(=O)N2CCCC2)=C1

InChI

InChIKey=LAPTWLCIZWFMJK-BQYQJAHWSA-N
InChI=1S/C14H17NO2/c1-17-13-6-4-5-12(11-13)7-8-14(16)15-9-2-3-10-15/h4-8,11H,2-3,9-10H2,1H3/b8-7+

HIDE SMILES / InChI

Molecular Formula C14H17NO2
Molecular Weight 231.2903
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 15:41:41 GMT 2023
Edited
by admin
on Sat Dec 16 15:41:41 GMT 2023
Record UNII
CM5B627XXN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(3-METHOXYPHENYL)-1-PYRROLIDIN-1-YL-PROP-2-EN-1-ONE
Systematic Name English
(2E)-3-(3-METHOXYPHENYL)-1-(1-PYRROLIDINYL)-2-PROPEN-1-ONE
Systematic Name English
2-PROPEN-1-ONE, 3-(3-METHOXYPHENYL)-1-(1-PYRROLIDINYL)-, (2E)-
Systematic Name English
PYRROLIDINE, 1-(3-(3-METHOXYPHENYL)-1-OXO-2-PROPENYL)-
Systematic Name English
1-(M-METHOXYCINNAMOYL)PYRROLIDINE
Systematic Name English
2-PROPEN-1-ONE, 3-(3-METHOXYPHENYL)-1-(1-PYRROLIDINYL)-
Systematic Name English
Code System Code Type Description
CAS
29647-01-6
Created by admin on Sat Dec 16 15:41:41 GMT 2023 , Edited by admin on Sat Dec 16 15:41:41 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CAS
486447-31-8
Created by admin on Sat Dec 16 15:41:41 GMT 2023 , Edited by admin on Sat Dec 16 15:41:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID30344202
Created by admin on Sat Dec 16 15:41:41 GMT 2023 , Edited by admin on Sat Dec 16 15:41:41 GMT 2023
PRIMARY
PUBCHEM
5373710
Created by admin on Sat Dec 16 15:41:41 GMT 2023 , Edited by admin on Sat Dec 16 15:41:41 GMT 2023
PRIMARY
FDA UNII
CM5B627XXN
Created by admin on Sat Dec 16 15:41:41 GMT 2023 , Edited by admin on Sat Dec 16 15:41:41 GMT 2023
PRIMARY